Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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2,521 – 2,535 of 158,801 results

2,521

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1,4-Bis(2-hydroxyisopropyl)benzene, 97%

CAS: 2948-46-1 Molecular Formula: C12H18O2 Molecular Weight (g/mol): 194.274 MDL Number: MFCD00009827 InChI Key: LEARFTRDZQQTDN-UHFFFAOYSA-N Synonym: 1,4-bis 2-hydroxy-2-propyl benzene,1,4-bis 1-methyl-1-hydroxyethyl benzene,alpha,alpha,alpha',alpha'-tetramethyl-1,4-benzenedimethanol,unii-g785drb5xh,p-bis 2-hydroxyisopropyl benzene,1,4-bis 2-hydroxyisopropyl benzene,p-bis alpha-hydroxyisopropyl benzene,g785drb5xh,alpha,alpha'-dihydroxy-p-diisopropylbenzene,alpha,alpha,alpha',alpha'-tetramethyl-p-xylylenediol PubChem CID: 18062 IUPAC Name: 2-[4-(2-hydroxypropan-2-yl)phenyl]propan-2-ol SMILES: CC(C)(C1=CC=C(C=C1)C(C)(C)O)O

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PubChem CID	18062
CAS	2948-46-1
Molecular Weight (g/mol)	194.274
MDL Number	MFCD00009827
SMILES	CC(C)(C1=CC=C(C=C1)C(C)(C)O)O
Synonym	1,4-bis 2-hydroxy-2-propyl benzene,1,4-bis 1-methyl-1-hydroxyethyl benzene,alpha,alpha,alpha',alpha'-tetramethyl-1,4-benzenedimethanol,unii-g785drb5xh,p-bis 2-hydroxyisopropyl benzene,1,4-bis 2-hydroxyisopropyl benzene,p-bis alpha-hydroxyisopropyl benzene,g785drb5xh,alpha,alpha'-dihydroxy-p-diisopropylbenzene,alpha,alpha,alpha',alpha'-tetramethyl-p-xylylenediol
IUPAC Name	2-[4-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
InChI Key	LEARFTRDZQQTDN-UHFFFAOYSA-N
Molecular Formula	C12H18O2

2,522

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4-Hydroxy-4'-nitrostilbene, 98%

CAS: 19221-08-0 Molecular Formula: C14H11NO3 Molecular Weight (g/mol): 241.246 MDL Number: MFCD00017044 InChI Key: OETQWIHJPIESQB-OWOJBTEDSA-N Synonym: 4-hydroxy-4'-nitrostilbene,4-4-nitrostyryl phenol,4-e-2-4-nitrophenyl ethenyl phenol,4-hydroxy-4/'-nitrostilbene,4-1e-2-4-nitrophenyl vinyl phenol,4'-nitrostilben-4-ol,cambridge id 5309411,e-4'-nitrostilbene-4-ol,e-4-4-nitrostyryl phenol PubChem CID: 759250 IUPAC Name: 4-[(E)-2-(4-nitrophenyl)ethenyl]phenol SMILES: C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)[N+](=O)[O-]

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PubChem CID	759250
CAS	19221-08-0
Molecular Weight (g/mol)	241.246
MDL Number	MFCD00017044
SMILES	C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)[N+](=O)[O-]
Synonym	4-hydroxy-4'-nitrostilbene,4-4-nitrostyryl phenol,4-e-2-4-nitrophenyl ethenyl phenol,4-hydroxy-4/'-nitrostilbene,4-1e-2-4-nitrophenyl vinyl phenol,4'-nitrostilben-4-ol,cambridge id 5309411,e-4'-nitrostilbene-4-ol,e-4-4-nitrostyryl phenol
IUPAC Name	4-[(E)-2-(4-nitrophenyl)ethenyl]phenol
InChI Key	OETQWIHJPIESQB-OWOJBTEDSA-N
Molecular Formula	C14H11NO3

2,523

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2,4-Dinitroaniline, 99% (dry wt.), cont. up to 15% water

CAS: 97-02-9 Molecular Formula: C6H5N3O4 Molecular Weight (g/mol): 183.12 MDL Number: MFCD00007151 InChI Key: LXQOQPGNCGEELI-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dinitro,1-amino-2,4-dinitrobenzene,2,4-dinitroanilin,2,4-dinitrobenzenamine,2,4-dinitroanilina,2,4-dinitraniline,2,4-dinitrophenylamine,aniline, 2,4-dinitro,2,4-dinitroaminobenzene,2,4-nitroaniline PubChem CID: 7321 ChEBI: CHEBI:34242 IUPAC Name: 2,4-dinitroaniline SMILES: NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

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Specifications

PubChem CID	7321
CAS	97-02-9
Molecular Weight (g/mol)	183.12
ChEBI	CHEBI:34242
MDL Number	MFCD00007151
SMILES	NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
Synonym	benzenamine, 2,4-dinitro,1-amino-2,4-dinitrobenzene,2,4-dinitroanilin,2,4-dinitrobenzenamine,2,4-dinitroanilina,2,4-dinitraniline,2,4-dinitrophenylamine,aniline, 2,4-dinitro,2,4-dinitroaminobenzene,2,4-nitroaniline
IUPAC Name	2,4-dinitroaniline
InChI Key	LXQOQPGNCGEELI-UHFFFAOYSA-N
Molecular Formula	C6H5N3O4

2,524

N-Fmoc-L-proline, 98%

CAS: 71989-31-6 Molecular Formula: C20H19NO4 Molecular Weight (g/mol): 337.38 MDL Number: MFCD00037122 InChI Key: ZPGDWQNBZYOZTI-UHFFFAOYNA-N Synonym: fmoc-pro-oh,fmoc-l-proline,fmoc-l-pro-oh,n-fmoc-l-proline,n-9-fluorenylmethoxycarbonyl-l-proline,s-1-9h-fluoren-9-yl methoxy carbonyl pyrrolidine-2-carboxylic acid,n-9h-fluoren-9-ylmethoxy carbonyl-l-proline,fmoc-pro,2s-1-9h-fluoren-9-ylmethoxy carbonyl pyrrolidine-2-carboxylic acid,9-fluorenylmethoxycarbonyl-l-proline PubChem CID: 688135 IUPAC Name: (2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)pyrrolidine-2-carboxylic acid SMILES: OC(=O)C1CCCN1C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

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Specifications

PubChem CID	688135
CAS	71989-31-6
Molecular Weight (g/mol)	337.38
MDL Number	MFCD00037122
SMILES	OC(=O)C1CCCN1C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12
Synonym	fmoc-pro-oh,fmoc-l-proline,fmoc-l-pro-oh,n-fmoc-l-proline,n-9-fluorenylmethoxycarbonyl-l-proline,s-1-9h-fluoren-9-yl methoxy carbonyl pyrrolidine-2-carboxylic acid,n-9h-fluoren-9-ylmethoxy carbonyl-l-proline,fmoc-pro,2s-1-9h-fluoren-9-ylmethoxy carbonyl pyrrolidine-2-carboxylic acid,9-fluorenylmethoxycarbonyl-l-proline
IUPAC Name	(2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)pyrrolidine-2-carboxylic acid
InChI Key	ZPGDWQNBZYOZTI-UHFFFAOYNA-N
Molecular Formula	C20H19NO4

2,525

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3-Methoxyphenylacetone, 97%

CAS: 3027-13-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008771 InChI Key: RMMRRRLPDBJBQL-UHFFFAOYSA-N Synonym: 3-methoxyphenylacetone,1-3-methoxyphenyl propan-2-one,1-3-methoxyphenyl acetone,3-methoxyphenyl acetone,m-methoxyphenyl acetone,m-methoxyphenylacetone,2-propanone, 1-3-methoxyphenyl,3-methoxyphenyl methyl ketone,acmc-1ai0k PubChem CID: 76410 IUPAC Name: 1-(3-methoxyphenyl)propan-2-one SMILES: COC1=CC=CC(CC(C)=O)=C1

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PubChem CID	76410
CAS	3027-13-2
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00008771
SMILES	COC1=CC=CC(CC(C)=O)=C1
Synonym	3-methoxyphenylacetone,1-3-methoxyphenyl propan-2-one,1-3-methoxyphenyl acetone,3-methoxyphenyl acetone,m-methoxyphenyl acetone,m-methoxyphenylacetone,2-propanone, 1-3-methoxyphenyl,3-methoxyphenyl methyl ketone,acmc-1ai0k
IUPAC Name	1-(3-methoxyphenyl)propan-2-one
InChI Key	RMMRRRLPDBJBQL-UHFFFAOYSA-N
Molecular Formula	C10H12O2

2,526

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3,5-Dichlorobenzhydrazide, 97%

CAS: 62899-78-9 Molecular Formula: C7H6Cl2N2O Molecular Weight (g/mol): 205.04 MDL Number: MFCD00833411 InChI Key: DNISXKBKTSHNKL-UHFFFAOYSA-N Synonym: 3,5-dichlorobenzhydrazide,3,5-dichlorobenzenecarbohydrazide,acmc-1b4zh,3,5-bis chloranyl benzohydrazide,3,5-dichlorobenzoic acid hydrazide,benzoic acid,3,5-dichloro-,hydrazide,benzoic acid,3,5-dichloro-, hydrazide PubChem CID: 2735966 IUPAC Name: 3,5-dichlorobenzohydrazide SMILES: NNC(=O)C1=CC(Cl)=CC(Cl)=C1

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PubChem CID	2735966
CAS	62899-78-9
Molecular Weight (g/mol)	205.04
MDL Number	MFCD00833411
SMILES	NNC(=O)C1=CC(Cl)=CC(Cl)=C1
Synonym	3,5-dichlorobenzhydrazide,3,5-dichlorobenzenecarbohydrazide,acmc-1b4zh,3,5-bis chloranyl benzohydrazide,3,5-dichlorobenzoic acid hydrazide,benzoic acid,3,5-dichloro-,hydrazide,benzoic acid,3,5-dichloro-, hydrazide
IUPAC Name	3,5-dichlorobenzohydrazide
InChI Key	DNISXKBKTSHNKL-UHFFFAOYSA-N
Molecular Formula	C7H6Cl2N2O

2,527

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3,5-Diiodosalicylic acid, 97%

CAS: 133-91-5 Molecular Formula: C7H4I2O3 Molecular Weight (g/mol): 389.915 MDL Number: MFCD00002444 InChI Key: DHZVWQPHNWDCFS-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylic acid,3,5-diiodo-2-hydroxybenzoic acid,benzoic acid, 2-hydroxy-3,5-diiodo,2-hydroxy-3,5-diiodobenzoate,3,5-diiodosalicylate,2-hydroxy-3,5-diiodobenzenecarboxylic acid,salicylic acid, 3,5-diiodo,2-hydroxy-3,5-diiodo-benzoic acid,benzoic acid, 3,5-diiodo-2-hydroxy,3,5-diiodosalicylicacid PubChem CID: 8631 IUPAC Name: 2-hydroxy-3,5-diiodobenzoic acid SMILES: C1=C(C=C(C(=C1I)O)C(=O)O)I

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PubChem CID	8631
CAS	133-91-5
Molecular Weight (g/mol)	389.915
MDL Number	MFCD00002444
SMILES	C1=C(C=C(C(=C1I)O)C(=O)O)I
Synonym	3,5-diiodosalicylic acid,3,5-diiodo-2-hydroxybenzoic acid,benzoic acid, 2-hydroxy-3,5-diiodo,2-hydroxy-3,5-diiodobenzoate,3,5-diiodosalicylate,2-hydroxy-3,5-diiodobenzenecarboxylic acid,salicylic acid, 3,5-diiodo,2-hydroxy-3,5-diiodo-benzoic acid,benzoic acid, 3,5-diiodo-2-hydroxy,3,5-diiodosalicylicacid
IUPAC Name	2-hydroxy-3,5-diiodobenzoic acid
InChI Key	DHZVWQPHNWDCFS-UHFFFAOYSA-N
Molecular Formula	C7H4I2O3

2,528

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5-Bromo-1,2,3-trifluorobenzene, 98%

CAS: 138526-69-9 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.981 MDL Number: MFCD00070738 InChI Key: HKJCELUUIFFSIN-UHFFFAOYSA-N Synonym: 1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide PubChem CID: 611409 IUPAC Name: 5-bromo-1,2,3-trifluorobenzene SMILES: C1=C(C=C(C(=C1F)F)F)Br

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PubChem CID	611409
CAS	138526-69-9
Molecular Weight (g/mol)	210.981
MDL Number	MFCD00070738
SMILES	C1=C(C=C(C(=C1F)F)F)Br
Synonym	1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide
IUPAC Name	5-bromo-1,2,3-trifluorobenzene
InChI Key	HKJCELUUIFFSIN-UHFFFAOYSA-N
Molecular Formula	C6H2BrF3

2,529

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3-Nitro-1,8-naphthalic anhydride, 98%

CAS: 3027-38-1 Molecular Formula: C12H5NO5 Molecular Weight (g/mol): 243.17 MDL Number: MFCD00006926 InChI Key: FLFLZYYDLIKGJQ-UHFFFAOYSA-N Synonym: 3-nitro-1,8-naphthalic anhydride,3-nitronaphthalic anhydride,naphthalic anhydride, 3-nitro,5-nitro-1h,3h-benzo de isochromene-1,3-dione,5-nitrobenzo de isochromene-1,3-dione,1h,3h-naphtho 1,8-cd pyran-1,3-dione, 5-nitro,11-nitro-3-oxatricyclo 7.3.1.0?, 1 3 trideca-1 13 ,5,7,9,11-pentaene-2,4-dione,7-nitro-3-oxatricyclo 7.3.1.0?, 1 3 trideca-1 13 ,5,7,9,11-pentaene-2,4-dione,5-17-11-00495 beilstein handbook reference PubChem CID: 18194 IUPAC Name: 11-nitro-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione SMILES: [O-][N+](=O)C1=CC2=C3C(C=CC=C3C(=O)OC2=O)=C1

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PubChem CID	18194
CAS	3027-38-1
Molecular Weight (g/mol)	243.17
MDL Number	MFCD00006926
SMILES	[O-][N+](=O)C1=CC2=C3C(C=CC=C3C(=O)OC2=O)=C1
Synonym	3-nitro-1,8-naphthalic anhydride,3-nitronaphthalic anhydride,naphthalic anhydride, 3-nitro,5-nitro-1h,3h-benzo de isochromene-1,3-dione,5-nitrobenzo de isochromene-1,3-dione,1h,3h-naphtho 1,8-cd pyran-1,3-dione, 5-nitro,11-nitro-3-oxatricyclo 7.3.1.0?, 1 3 trideca-1 13 ,5,7,9,11-pentaene-2,4-dione,7-nitro-3-oxatricyclo 7.3.1.0?, 1 3 trideca-1 13 ,5,7,9,11-pentaene-2,4-dione,5-17-11-00495 beilstein handbook reference
IUPAC Name	11-nitro-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione
InChI Key	FLFLZYYDLIKGJQ-UHFFFAOYSA-N
Molecular Formula	C12H5NO5

2,530

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1-Bromo-3,4-dichlorobenzene, 98+%

CAS: 18282-59-2 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.89 MDL Number: MFCD00040849 InChI Key: CFPZDVAZISWERM-UHFFFAOYSA-N Synonym: 1-bromo-3,4-dichlorobenzene,3,4-dichlorobromobenzene,benzene, 4-bromo-1,2-dichloro,3,4-dichlorophenyl bromide,3,4-dichloro-1-bromobenzene,4-bromo-1,2-dichloro-benzene,5-bromdichlorbenzol,pubchem3611,acmc-1btol,3,4-dichloro-bromobenzene PubChem CID: 29013 IUPAC Name: 4-bromo-1,2-dichlorobenzene SMILES: ClC1=CC=C(Br)C=C1Cl

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Specifications

PubChem CID	29013
CAS	18282-59-2
Molecular Weight (g/mol)	225.89
MDL Number	MFCD00040849
SMILES	ClC1=CC=C(Br)C=C1Cl
Synonym	1-bromo-3,4-dichlorobenzene,3,4-dichlorobromobenzene,benzene, 4-bromo-1,2-dichloro,3,4-dichlorophenyl bromide,3,4-dichloro-1-bromobenzene,4-bromo-1,2-dichloro-benzene,5-bromdichlorbenzol,pubchem3611,acmc-1btol,3,4-dichloro-bromobenzene
IUPAC Name	4-bromo-1,2-dichlorobenzene
InChI Key	CFPZDVAZISWERM-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

2,531

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2-Nitrobenzoic acid, 95%

CAS: 552-16-9 Molecular Formula: C₇H₅NO₄ Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007137 InChI Key: SLAMLWHELXOEJZ-UHFFFAOYSA-N Synonym: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]

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Specifications

PubChem CID	11087
CAS	552-16-9
Molecular Weight (g/mol)	167.12
ChEBI	CHEBI:25620
MDL Number	MFCD00007137
SMILES	C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
Synonym	2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid
InChI Key	SLAMLWHELXOEJZ-UHFFFAOYSA-N
Molecular Formula	C₇H₅NO₄

2,532

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3-Chlorobenzylamine, 98%

CAS: 4152-90-3 Molecular Formula: C₇H₈ClN Molecular Weight (g/mol): 141.6 MDL Number: MFCD00040752 InChI Key: BJFPYGGTDAYECS-UHFFFAOYSA-N Synonym: 3-chlorobenzylamine,3-chlorophenyl methanamine,benzenemethanamine, 3-chloro,1-3-chlorophenyl methanamine,m-chlorobenzylamine,3-chloro-benzylamine,m-chlorobenzyl amine,3-chlorophenyl methylamine,chembl12957,c2a PubChem CID: 77802 IUPAC Name: (3-chlorophenyl)methanamine SMILES: C1=CC(=CC(=C1)Cl)CN

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Specifications

PubChem CID	77802
CAS	4152-90-3
Molecular Weight (g/mol)	141.6
MDL Number	MFCD00040752
SMILES	C1=CC(=CC(=C1)Cl)CN
Synonym	3-chlorobenzylamine,3-chlorophenyl methanamine,benzenemethanamine, 3-chloro,1-3-chlorophenyl methanamine,m-chlorobenzylamine,3-chloro-benzylamine,m-chlorobenzyl amine,3-chlorophenyl methylamine,chembl12957,c2a
IUPAC Name	(3-chlorophenyl)methanamine
InChI Key	BJFPYGGTDAYECS-UHFFFAOYSA-N
Molecular Formula	C₇H₈ClN

2,533

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4-Cyanostyrene, 95%, stabilized

CAS: 3435-51-6 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00080445 InChI Key: SNTUCKQYWGHZPK-UHFFFAOYSA-N PubChem CID: 76967 IUPAC Name: 4-ethenylbenzonitrile SMILES: C=CC1=CC=C(C=C1)C#N

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Specifications

PubChem CID	76967
CAS	3435-51-6
Molecular Weight (g/mol)	129.16
MDL Number	MFCD00080445
SMILES	C=CC1=CC=C(C=C1)C#N
IUPAC Name	4-ethenylbenzonitrile
InChI Key	SNTUCKQYWGHZPK-UHFFFAOYSA-N
Molecular Formula	C9H7N

2,534

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2,3,5,6-Tetrafluoro-7,7,8,8-tetracyanoquinodimethane, 95%

CAS: 29261-33-4 Molecular Formula: C₁₂F₄N₄ Molecular Weight (g/mol): 276.16 InChI Key: IXHWGNYCZPISET-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane,2,2'-perfluorocyclohexa-2,5-diene-1,4-diylidene dimalononitrile,tcnqf4,2,3,5,6-tetrafluorotetracyanoquinodimethane,f4-tcnq,tetrafluorotetracyanoquinodimethane,2-4-dicyanomethylidene-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene propanedinitrile,f4tcnq,tetrafluorotetracyanoquinodimethane anion radical,tetrafluorotetracyanoquinodimethane purifiedbysubl PubChem CID: 2733307 IUPAC Name: 2-[4-(dicyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile SMILES: C(#N)C(=C1C(=C(C(=C(C#N)C#N)C(=C1F)F)F)F)C#N

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Specifications

PubChem CID	2733307
CAS	29261-33-4
Molecular Weight (g/mol)	276.16
SMILES	C(#N)C(=C1C(=C(C(=C(C#N)C#N)C(=C1F)F)F)F)C#N
Synonym	2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane,2,2'-perfluorocyclohexa-2,5-diene-1,4-diylidene dimalononitrile,tcnqf4,2,3,5,6-tetrafluorotetracyanoquinodimethane,f4-tcnq,tetrafluorotetracyanoquinodimethane,2-4-dicyanomethylidene-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene propanedinitrile,f4tcnq,tetrafluorotetracyanoquinodimethane anion radical,tetrafluorotetracyanoquinodimethane purifiedbysubl
IUPAC Name	2-[4-(dicyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile
InChI Key	IXHWGNYCZPISET-UHFFFAOYSA-N
Molecular Formula	C₁₂F₄N₄

2,535

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3-Carbamoyl-4-fluorobenzeneboronic acid, 97%

CAS: 874219-34-8 Molecular Formula: C7H7BFNO3 Molecular Weight (g/mol): 182.945 MDL Number: MFCD08235053 InChI Key: RNNYXSWJFLHIRC-UHFFFAOYSA-N Synonym: 3-carbamoyl-4-fluorophenyl boronic acid,3-carbamoyl-4-fluorobenzeneboronic acid,3-aminocarbonyl-4-fluorophenylboronic acid,3-aminocarbonyl-4-fluorobenzeneboronic acid,acmc-209qky,3-carbamoyl-4-fluorophenyl boronicacid,4-fluoro-3-carbamoyl phenylboronic acid,3-aminocarbonyl-4-fluoranyl-phenyl boronic acid,boronic acid,b-3-aminocarbonyl-4-fluorophenyl PubChem CID: 44717530 IUPAC Name: (3-carbamoyl-4-fluorophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)F)C(=O)N)(O)O

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Specifications

PubChem CID	44717530
CAS	874219-34-8
Molecular Weight (g/mol)	182.945
MDL Number	MFCD08235053
SMILES	B(C1=CC(=C(C=C1)F)C(=O)N)(O)O
Synonym	3-carbamoyl-4-fluorophenyl boronic acid,3-carbamoyl-4-fluorobenzeneboronic acid,3-aminocarbonyl-4-fluorophenylboronic acid,3-aminocarbonyl-4-fluorobenzeneboronic acid,acmc-209qky,3-carbamoyl-4-fluorophenyl boronicacid,4-fluoro-3-carbamoyl phenylboronic acid,3-aminocarbonyl-4-fluoranyl-phenyl boronic acid,boronic acid,b-3-aminocarbonyl-4-fluorophenyl
IUPAC Name	(3-carbamoyl-4-fluorophenyl)boronic acid
InChI Key	RNNYXSWJFLHIRC-UHFFFAOYSA-N
Molecular Formula	C7H7BFNO3

Benzenoids

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