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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9,841 – 9,855 of 104,965 results

9,841

4-Nitrothioanisole 98.0+%, TCI America™

CAS: 701-57-5 Molecular Formula: C7H7NO2S Molecular Weight (g/mol): 169.198 InChI Key: NEZGPRYOJVPJKL-UHFFFAOYSA-N Synonym: 4-nitrothioanisole,1-methylthio-4-nitrobenzene,methyl 4-nitrophenyl sulfide,1-methylsulfanyl-4-nitrobenzene,benzene, 1-methylthio-4-nitro,methyl 4-nitrophenyl sulphide,1-methylsulfanyl-4-nitro-benzene,pubchem10631,4-methylthio nitrobenzene PubChem CID: 96109 IUPAC Name: 1-methylsulfanyl-4-nitrobenzene SMILES: CSC1=CC=C(C=C1)[N+](=O)[O-]

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PubChem CID	96109
CAS	701-57-5
Molecular Weight (g/mol)	169.198
SMILES	CSC1=CC=C(C=C1)[N+](=O)[O-]
Synonym	4-nitrothioanisole,1-methylthio-4-nitrobenzene,methyl 4-nitrophenyl sulfide,1-methylsulfanyl-4-nitrobenzene,benzene, 1-methylthio-4-nitro,methyl 4-nitrophenyl sulphide,1-methylsulfanyl-4-nitro-benzene,pubchem10631,4-methylthio nitrobenzene
IUPAC Name	1-methylsulfanyl-4-nitrobenzene
InChI Key	NEZGPRYOJVPJKL-UHFFFAOYSA-N
Molecular Formula	C7H7NO2S

9,842

4-Hydrazinobenzenesulfonamide Hydrochloride 98.0+%, TCI America™

CAS: 17852-52-7 Molecular Formula: C6H10ClN3O2S Molecular Weight (g/mol): 223.675 MDL Number: MFCD00052262 InChI Key: IKEURONJLPUALY-UHFFFAOYSA-N Synonym: 4-hydrazinylbenzenesulfonamide hydrochloride,4-hydrazinobenzene-1-sulfonamide hydrochloride,4-hydrazinobenzenesulfonamide hydrochloride,4-sulfonamidephenylhydrazine hcl,4-aminosulfonylphenylhydrazine hydrochloride,4-hydrazinylbenzenesulfonamide hydrochloride 1:x,4-sulfamoylphenyl hydrazine hydrochloride,4-sulfonamide-phenylhydrazine hcl,phenylhydrazine-4-sulfonamide hydrochloride PubChem CID: 2794567 IUPAC Name: 4-hydrazinylbenzenesulfonamide;hydrochloride SMILES: C1=CC(=CC=C1NN)S(=O)(=O)N.Cl

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Specifications

PubChem CID	2794567
CAS	17852-52-7
Molecular Weight (g/mol)	223.675
MDL Number	MFCD00052262
SMILES	C1=CC(=CC=C1NN)S(=O)(=O)N.Cl
Synonym	4-hydrazinylbenzenesulfonamide hydrochloride,4-hydrazinobenzene-1-sulfonamide hydrochloride,4-hydrazinobenzenesulfonamide hydrochloride,4-sulfonamidephenylhydrazine hcl,4-aminosulfonylphenylhydrazine hydrochloride,4-hydrazinylbenzenesulfonamide hydrochloride 1:x,4-sulfamoylphenyl hydrazine hydrochloride,4-sulfonamide-phenylhydrazine hcl,phenylhydrazine-4-sulfonamide hydrochloride
IUPAC Name	4-hydrazinylbenzenesulfonamide;hydrochloride
InChI Key	IKEURONJLPUALY-UHFFFAOYSA-N
Molecular Formula	C6H10ClN3O2S

9,843

N-Cyclohexyl-p-toluenesulfonamide 99.0+%, TCI America™

CAS: 80-30-8 Molecular Formula: C13H19NO2S Molecular Weight (g/mol): 253.36 MDL Number: MFCD00014285 InChI Key: DKYVVNLWACXMDW-UHFFFAOYSA-N Synonym: n-cyclohexyl-p-toluenesulfonamide,santicizer 1h,p-toluenesulfonamide, n-cyclohexyl,benzenesulfonamide, n-cyclohexyl-4-methyl,tosylamino cyclohexane,ccris 6008,unii-0qpv1ae9em,n-cyclohexyltoluene-4-sulphonamide,n-cyclohexyl-4-methyl-benzenesulfonamide,0qpv1ae9em PubChem CID: 6633 IUPAC Name: N-cyclohexyl-4-methylbenzene-1-sulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC1CCCCC1

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Specifications

PubChem CID	6633
CAS	80-30-8
Molecular Weight (g/mol)	253.36
MDL Number	MFCD00014285
SMILES	CC1=CC=C(C=C1)S(=O)(=O)NC1CCCCC1
Synonym	n-cyclohexyl-p-toluenesulfonamide,santicizer 1h,p-toluenesulfonamide, n-cyclohexyl,benzenesulfonamide, n-cyclohexyl-4-methyl,tosylamino cyclohexane,ccris 6008,unii-0qpv1ae9em,n-cyclohexyltoluene-4-sulphonamide,n-cyclohexyl-4-methyl-benzenesulfonamide,0qpv1ae9em
IUPAC Name	N-cyclohexyl-4-methylbenzene-1-sulfonamide
InChI Key	DKYVVNLWACXMDW-UHFFFAOYSA-N
Molecular Formula	C13H19NO2S

9,844

1,8,9-Trihydroxyanthracene 95.0+%, TCI America™

CAS: 480-22-8 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.231 MDL Number: MFCD00001250 InChI Key: YUTJCNNFTOIOGT-UHFFFAOYSA-N Synonym: Anthralin, Dithranol, 1,8,9-Anthracenetriol, 1,8-Dihydroxy-9(10H)-anthracenone, DIT PubChem CID: 10187 ChEBI: CHEBI:2756 IUPAC Name: anthracene-1,8,9-triol SMILES: C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O

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Specifications

PubChem CID	10187
CAS	480-22-8
Molecular Weight (g/mol)	226.231
ChEBI	CHEBI:2756
MDL Number	MFCD00001250
SMILES	C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O
Synonym	Anthralin, Dithranol, 1,8,9-Anthracenetriol, 1,8-Dihydroxy-9(10H)-anthracenone, DIT
IUPAC Name	anthracene-1,8,9-triol
InChI Key	YUTJCNNFTOIOGT-UHFFFAOYSA-N
Molecular Formula	C14H10O3

9,845

4-Bromobenz[a]anthracene 97.0+%, TCI America™

CAS: 61921-39-9 Molecular Formula: C18H11Br Molecular Weight (g/mol): 307.19 MDL Number: MFCD25371993 InChI Key: ILVKEMDEUCXCAB-UHFFFAOYSA-N Synonym: 4-Bromotetraphene PubChem CID: 182324 IUPAC Name: 4-bromobenzo[a]anthracene SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br

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Specifications

PubChem CID	182324
CAS	61921-39-9
Molecular Weight (g/mol)	307.19
MDL Number	MFCD25371993
SMILES	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br
Synonym	4-Bromotetraphene
IUPAC Name	4-bromobenzo[a]anthracene
InChI Key	ILVKEMDEUCXCAB-UHFFFAOYSA-N
Molecular Formula	C18H11Br

9,846

1-Bromoanthracene (purified by sublimation) 98.0+%, TCI America™

CAS: 7397-92-4 Molecular Formula: C14H9Br Molecular Weight (g/mol): 257.13 MDL Number: MFCD08276282 InChI Key: XMWJLKOCNKJERQ-UHFFFAOYSA-N PubChem CID: 12529827 IUPAC Name: 1-bromoanthracene SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC=C3Br

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Specifications

PubChem CID	12529827
CAS	7397-92-4
Molecular Weight (g/mol)	257.13
MDL Number	MFCD08276282
SMILES	C1=CC=C2C=C3C(=CC2=C1)C=CC=C3Br
IUPAC Name	1-bromoanthracene
InChI Key	XMWJLKOCNKJERQ-UHFFFAOYSA-N
Molecular Formula	C14H9Br

9,847

2,4-Dichlorophenol 98.0+%, TCI America™

CAS: 120-83-2 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163.00 MDL Number: MFCD00002169 InChI Key: HFZWRUODUSTPEG-UHFFFAOYSA-N Synonym: 4,6-dichlorophenol,phenol, 2,4-dichloro,2,4-dcp,2,4-dichloro-phenol,1-hydroxy-2,4-dichlorobenzene,rcra waste number u081,2,4-dichlorohydroxybenzene,ccris 657,rcra waste no. u081,1,3-dichloro-4-hydroxybenzene PubChem CID: 8449 ChEBI: CHEBI:16738 IUPAC Name: 2,4-dichlorophenol SMILES: OC1=CC=C(Cl)C=C1Cl

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Specifications

PubChem CID	8449
CAS	120-83-2
Molecular Weight (g/mol)	163.00
ChEBI	CHEBI:16738
MDL Number	MFCD00002169
SMILES	OC1=CC=C(Cl)C=C1Cl
Synonym	4,6-dichlorophenol,phenol, 2,4-dichloro,2,4-dcp,2,4-dichloro-phenol,1-hydroxy-2,4-dichlorobenzene,rcra waste number u081,2,4-dichlorohydroxybenzene,ccris 657,rcra waste no. u081,1,3-dichloro-4-hydroxybenzene
IUPAC Name	2,4-dichlorophenol
InChI Key	HFZWRUODUSTPEG-UHFFFAOYSA-N
Molecular Formula	C6H4Cl2O

9,848

2,5-Difluorophenol 95.0+%, TCI America™

CAS: 2713-31-7 Molecular Formula: C6H4F2O Molecular Weight (g/mol): 130.09 MDL Number: MFCD00042501 InChI Key: INXKVYFOWNAVMU-UHFFFAOYSA-N Synonym: phenol, 2,5-difluoro,1,4-difluoro-2-hydroxybenzene,phenol,2,5-difluoro,2,5-difluorphenol,2,5-difluorophenol;2,5-difluorophenol;,2 5-difluorophenol,2,5-difluoro phenol,2,5-difluoro-phenol,phenol derivative, 5,pubchem3464 PubChem CID: 94952 IUPAC Name: 2,5-difluorophenol SMILES: OC1=CC(F)=CC=C1F

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Specifications

PubChem CID	94952
CAS	2713-31-7
Molecular Weight (g/mol)	130.09
MDL Number	MFCD00042501
SMILES	OC1=CC(F)=CC=C1F
Synonym	phenol, 2,5-difluoro,1,4-difluoro-2-hydroxybenzene,phenol,2,5-difluoro,2,5-difluorphenol,2,5-difluorophenol;2,5-difluorophenol;,2 5-difluorophenol,2,5-difluoro phenol,2,5-difluoro-phenol,phenol derivative, 5,pubchem3464
IUPAC Name	2,5-difluorophenol
InChI Key	INXKVYFOWNAVMU-UHFFFAOYSA-N
Molecular Formula	C6H4F2O

9,849

N-Methylbenzenesulfonamide 98.0+%, TCI America™

CAS: 5183-78-8 Molecular Formula: C7H9NO2S Molecular Weight (g/mol): 171.21 MDL Number: MFCD00025023 InChI Key: SVDVKEBISAOWJT-UHFFFAOYSA-N Synonym: benzenesulfonamide, n-methyl,n-methylbenzenesulphonamide,n-phenylsulfonyl methanamine,methyl phenylsulfonyl amine,n-methylphenylsulfonamide,acmc-1avn9,n-methylbenzene sulfonamide,n-methyl benzenesulphonamide,benzenesulfonamide,n-methyl,benzenesulfonyl-n-methylamide PubChem CID: 78858 IUPAC Name: N-methylbenzenesulfonamide SMILES: CNS(=O)(=O)C1=CC=CC=C1

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Specifications

PubChem CID	78858
CAS	5183-78-8
Molecular Weight (g/mol)	171.21
MDL Number	MFCD00025023
SMILES	CNS(=O)(=O)C1=CC=CC=C1
Synonym	benzenesulfonamide, n-methyl,n-methylbenzenesulphonamide,n-phenylsulfonyl methanamine,methyl phenylsulfonyl amine,n-methylphenylsulfonamide,acmc-1avn9,n-methylbenzene sulfonamide,n-methyl benzenesulphonamide,benzenesulfonamide,n-methyl,benzenesulfonyl-n-methylamide
IUPAC Name	N-methylbenzenesulfonamide
InChI Key	SVDVKEBISAOWJT-UHFFFAOYSA-N
Molecular Formula	C7H9NO2S

9,850

N-Benzylidenebenzenesulfonamide 98.0+%, TCI America™

CAS: 13909-34-7 Molecular Formula: C13H11NO2S Molecular Weight (g/mol): 245.30 MDL Number: MFCD00011587 InChI Key: MPNRJEPBAYEQBY-UHFFFAOYSA-N PubChem CID: 9602006 IUPAC Name: N-(phenylmethylidene)benzenesulfonamide SMILES: O=S(=O)(N=CC1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	9602006
CAS	13909-34-7
Molecular Weight (g/mol)	245.30
MDL Number	MFCD00011587
SMILES	O=S(=O)(N=CC1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name	N-(phenylmethylidene)benzenesulfonamide
InChI Key	MPNRJEPBAYEQBY-UHFFFAOYSA-N
Molecular Formula	C13H11NO2S

9,851

2-(9-Anthryl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 98.0+%, TCI America™

CAS: 709022-63-9 Molecular Formula: C20H21BO2 Molecular Weight (g/mol): 304.196 MDL Number: MFCD24039741 InChI Key: GBHRGHJTZFOAKE-UHFFFAOYSA-N PubChem CID: 18533854 IUPAC Name: 2-anthracen-9-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C3C=CC=CC3=CC4=CC=CC=C24

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Specifications

PubChem CID	18533854
CAS	709022-63-9
Molecular Weight (g/mol)	304.196
MDL Number	MFCD24039741
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=C3C=CC=CC3=CC4=CC=CC=C24
IUPAC Name	2-anthracen-9-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key	GBHRGHJTZFOAKE-UHFFFAOYSA-N
Molecular Formula	C20H21BO2

9,852

2-Chloroanthracene 98.0+%, TCI America™

CAS: 17135-78-3 Molecular Formula: C14H9Cl Molecular Weight (g/mol): 212.676 InChI Key: OWFINXQLBMJDJQ-UHFFFAOYSA-N Synonym: anthracene, 2-chloro,ccris 5549,.beta.-chloro anthracene,2-chloroanthracene,acmc-1c5s8,dsstox_cid_29086,dsstox_rid_83305,dsstox_gsid_49230,4-05-00-02292 beilstein handbook reference,owfinxqlbmjdjq-uhfffaoysa PubChem CID: 28308 IUPAC Name: 2-chloroanthracene SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)Cl

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Specifications

PubChem CID	28308
CAS	17135-78-3
Molecular Weight (g/mol)	212.676
SMILES	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)Cl
Synonym	anthracene, 2-chloro,ccris 5549,.beta.-chloro anthracene,2-chloroanthracene,acmc-1c5s8,dsstox_cid_29086,dsstox_rid_83305,dsstox_gsid_49230,4-05-00-02292 beilstein handbook reference,owfinxqlbmjdjq-uhfffaoysa
IUPAC Name	2-chloroanthracene
InChI Key	OWFINXQLBMJDJQ-UHFFFAOYSA-N
Molecular Formula	C14H9Cl

9,853

Sulfalene 98.0+%, TCI America™

CAS: 152-47-6 Molecular Formula: C11H12N4O3S Molecular Weight (g/mol): 280.302 MDL Number: MFCD00437754 InChI Key: KXRZBTAEDBELFD-UHFFFAOYSA-N Synonym: 4-Amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide, N-(3-Methoxypyrazin-2-yl)sulfanilamide PubChem CID: 9047 ChEBI: CHEBI:32162 IUPAC Name: 4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide SMILES: COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N

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Specifications

PubChem CID	9047
CAS	152-47-6
Molecular Weight (g/mol)	280.302
ChEBI	CHEBI:32162
MDL Number	MFCD00437754
SMILES	COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N
Synonym	4-Amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide, N-(3-Methoxypyrazin-2-yl)sulfanilamide
IUPAC Name	4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide
InChI Key	KXRZBTAEDBELFD-UHFFFAOYSA-N
Molecular Formula	C11H12N4O3S

9,854

Ethylene Glycol Bis(2-nitrophenyl) Ether 98.0+%, TCI America™

CAS: 51661-19-9 Molecular Formula: C14H12N2O6 Molecular Weight (g/mol): 304.26 MDL Number: MFCD00024226 InChI Key: DEHTVRKGDUCXRF-UHFFFAOYSA-N Synonym: 1,2-bis o-nitrophenoxy ethane,1,2-bis 2-nitrophenoxy ethane,1-nitro-2-2-2-nitrophenoxy ethoxy benzene,ethylene glycol bis 2-nitrophenyl ether,1,1'-ethane-1,2-diylbis oxy bis 2-nitrobenzene,bis 2-nitrophenoxy ethane,acmc-20a59z,1,2-di o-nitrophenoxy ethane,2,2'-ethylenedioxy bis 1-nitrobenzene,2-nitro-1-2-2-nitrophenoxy ethoxy benzene PubChem CID: 394580 IUPAC Name: 1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene SMILES: [O-][N+](=O)C1=CC=CC=C1OCCOC1=CC=CC=C1[N+]([O-])=O

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Specifications

PubChem CID	394580
CAS	51661-19-9
Molecular Weight (g/mol)	304.26
MDL Number	MFCD00024226
SMILES	[O-][N+](=O)C1=CC=CC=C1OCCOC1=CC=CC=C1[N+]([O-])=O
Synonym	1,2-bis o-nitrophenoxy ethane,1,2-bis 2-nitrophenoxy ethane,1-nitro-2-2-2-nitrophenoxy ethoxy benzene,ethylene glycol bis 2-nitrophenyl ether,1,1'-ethane-1,2-diylbis oxy bis 2-nitrobenzene,bis 2-nitrophenoxy ethane,acmc-20a59z,1,2-di o-nitrophenoxy ethane,2,2'-ethylenedioxy bis 1-nitrobenzene,2-nitro-1-2-2-nitrophenoxy ethoxy benzene
IUPAC Name	1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
InChI Key	DEHTVRKGDUCXRF-UHFFFAOYSA-N
Molecular Formula	C14H12N2O6

9,855

5-Bromo-3-nitrosalicylaldehyde 97.0+%, TCI America™

CAS: 16634-88-1 Molecular Formula: C7H4BrNO4 Molecular Weight (g/mol): 246.016 MDL Number: MFCD00130110 InChI Key: YEYPSUQQZNDKDE-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxy-3-nitrobenzaldehyde,5-bromo-3-nitrosalicylaldehyde,benzaldehyde, 5-bromo-2-hydroxy-3-nitro,3-nitro-5-bromosalicylaldehyde,benzaldehyde,5-bromo-2-hydroxy-3-nitro,salicylaldehyde, 5-bromo-3-nitro,acmc-209du3,5-bromo-3-nitrosalicyladehyde,2-hydroxy-3-nitro-5-bromobenzaldehyde PubChem CID: 618699 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C=O)Br

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Specifications

PubChem CID	618699
CAS	16634-88-1
Molecular Weight (g/mol)	246.016
MDL Number	MFCD00130110
SMILES	C1=C(C=C(C(=C1[N+](=O)[O-])O)C=O)Br
Synonym	5-bromo-2-hydroxy-3-nitrobenzaldehyde,5-bromo-3-nitrosalicylaldehyde,benzaldehyde, 5-bromo-2-hydroxy-3-nitro,3-nitro-5-bromosalicylaldehyde,benzaldehyde,5-bromo-2-hydroxy-3-nitro,salicylaldehyde, 5-bromo-3-nitro,acmc-209du3,5-bromo-3-nitrosalicyladehyde,2-hydroxy-3-nitro-5-bromobenzaldehyde
InChI Key	YEYPSUQQZNDKDE-UHFFFAOYSA-N
Molecular Formula	C7H4BrNO4

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