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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2,596 – 2,610 of 78,024 results

2,596

Methyl 2-iodobenzoate, 99+%

CAS: 610-97-9 Molecular Formula: C₈H₇IO₂ Molecular Weight (g/mol): 262.04 MDL Number: MFCD00016351 InChI Key: BXXLTVBTDZXPTN-UHFFFAOYSA-N Synonym: 2-iodobenzoic acid methyl ester,methyl o-iodobenzoate,methyl-2-iodobenzoate,benzoic acid, 2-iodo-, methyl ester,2-iodo-benzoic acid methyl ester,methyl2-iodobenzoate,benzoic acid, o-iodo-, methyl ester,methyl 2-iodo-benzoate,pubchem10568,acmc-209mp0 PubChem CID: 69132 IUPAC Name: methyl 2-iodobenzoate SMILES: COC(=O)C1=CC=CC=C1I

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PubChem CID	69132
CAS	610-97-9
Molecular Weight (g/mol)	262.04
MDL Number	MFCD00016351
SMILES	COC(=O)C1=CC=CC=C1I
Synonym	2-iodobenzoic acid methyl ester,methyl o-iodobenzoate,methyl-2-iodobenzoate,benzoic acid, 2-iodo-, methyl ester,2-iodo-benzoic acid methyl ester,methyl2-iodobenzoate,benzoic acid, o-iodo-, methyl ester,methyl 2-iodo-benzoate,pubchem10568,acmc-209mp0
IUPAC Name	methyl 2-iodobenzoate
InChI Key	BXXLTVBTDZXPTN-UHFFFAOYSA-N
Molecular Formula	C₈H₇IO₂

2,597

3-Fluorobenzoic acid, 99%

CAS: 455-38-9 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.11 MDL Number: MFCD00002489 InChI Key: MXNBDFWNYRNIBH-UHFFFAOYSA-N Synonym: m-fluorobenzoic acid,benzoic acid, 3-fluoro,meta-fluorobenzoic acid,benzoic acid, m-fluoro,3-fluoro-benzoic acid,3-fluorobenzoicacid,pubchem3480,3-fluorobenzoic acid,ksc235q1b,paragos 390192 PubChem CID: 9968 ChEBI: CHEBI:20021 IUPAC Name: 3-fluorobenzoic acid SMILES: OC(=O)C1=CC=CC(F)=C1

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PubChem CID	9968
CAS	455-38-9
Molecular Weight (g/mol)	140.11
ChEBI	CHEBI:20021
MDL Number	MFCD00002489
SMILES	OC(=O)C1=CC=CC(F)=C1
Synonym	m-fluorobenzoic acid,benzoic acid, 3-fluoro,meta-fluorobenzoic acid,benzoic acid, m-fluoro,3-fluoro-benzoic acid,3-fluorobenzoicacid,pubchem3480,3-fluorobenzoic acid,ksc235q1b,paragos 390192
IUPAC Name	3-fluorobenzoic acid
InChI Key	MXNBDFWNYRNIBH-UHFFFAOYSA-N
Molecular Formula	C7H5FO2

2,598

2-Fluoro-6-methoxybenzamide, 98%

CAS: 529512-81-0 Molecular Formula: C8H8FNO2 Molecular Weight (g/mol): 169.16 MDL Number: MFCD00277474 InChI Key: BDJNFURQDZEPLK-UHFFFAOYSA-N Synonym: 2-fluoro-6-methoxy-benzamide,2-methoxy-6-fluorobenzamide,2-fluoro-6-methoxy benzamide,#,benzamide, 2-fluoro-6-methoxy PubChem CID: 579738 IUPAC Name: 2-fluoro-6-methoxybenzamide SMILES: COC1=C(C(N)=O)C(F)=CC=C1

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Specifications

PubChem CID	579738
CAS	529512-81-0
Molecular Weight (g/mol)	169.16
MDL Number	MFCD00277474
SMILES	COC1=C(C(N)=O)C(F)=CC=C1
Synonym	2-fluoro-6-methoxy-benzamide,2-methoxy-6-fluorobenzamide,2-fluoro-6-methoxy benzamide,#,benzamide, 2-fluoro-6-methoxy
IUPAC Name	2-fluoro-6-methoxybenzamide
InChI Key	BDJNFURQDZEPLK-UHFFFAOYSA-N
Molecular Formula	C8H8FNO2

2,599

2,6-Dichlorobenzamide, 97%

CAS: 2008-58-4 Molecular Formula: C₇H₅Cl₂NO Molecular Weight (g/mol): 190.03 MDL Number: MFCD00007975 InChI Key: JHSPCUHPSIUQRB-UHFFFAOYSA-N Synonym: benzamide, 2,6-dichloro,2,6-bam,unii-e9jwf529eb,2,6-dichlorobenzoic acid amide,bam,e9jwf529eb,benzamide,6-dichloro,dsstox_cid_2170,acmc-209f5j,dsstox_rid_76511 PubChem CID: 16183 ChEBI: CHEBI:28435 IUPAC Name: 2,6-dichlorobenzamide SMILES: C1=CC(=C(C(=C1)Cl)C(=O)N)Cl

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Specifications

PubChem CID	16183
CAS	2008-58-4
Molecular Weight (g/mol)	190.03
ChEBI	CHEBI:28435
MDL Number	MFCD00007975
SMILES	C1=CC(=C(C(=C1)Cl)C(=O)N)Cl
Synonym	benzamide, 2,6-dichloro,2,6-bam,unii-e9jwf529eb,2,6-dichlorobenzoic acid amide,bam,e9jwf529eb,benzamide,6-dichloro,dsstox_cid_2170,acmc-209f5j,dsstox_rid_76511
IUPAC Name	2,6-dichlorobenzamide
InChI Key	JHSPCUHPSIUQRB-UHFFFAOYSA-N
Molecular Formula	C₇H₅Cl₂NO

2,600

3,5-Dibromosalicylic acid, 97%, Thermo Scientific™

CAS: 3147-55-5 Molecular Formula: C₇H₄Br₂O₃ Molecular Weight (g/mol): 295.9 InChI Key: BFBZHSOXKROMBG-UHFFFAOYSA-N Synonym: 3,5-dibromosalicylic acid,benzoic acid, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzoic acid,unii-t5jo5ua21h,salicylic acid, 3,5-dibromo,t5jo5ua21h,rarechem al bo 2002,attercop-chm at113669,labotest-bb lt00455167,labotest-bb lt03333482 PubChem CID: 18464 IUPAC Name: 3,5-dibromo-2-hydroxybenzoic acid SMILES: C1=C(C=C(C(=C1Br)O)C(=O)O)Br

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PubChem CID	18464
CAS	3147-55-5
Molecular Weight (g/mol)	295.9
SMILES	C1=C(C=C(C(=C1Br)O)C(=O)O)Br
Synonym	3,5-dibromosalicylic acid,benzoic acid, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzoic acid,unii-t5jo5ua21h,salicylic acid, 3,5-dibromo,t5jo5ua21h,rarechem al bo 2002,attercop-chm at113669,labotest-bb lt00455167,labotest-bb lt03333482
IUPAC Name	3,5-dibromo-2-hydroxybenzoic acid
InChI Key	BFBZHSOXKROMBG-UHFFFAOYSA-N
Molecular Formula	C₇H₄Br₂O₃

2,601

5-Fluoro-2-methylbenzoyl chloride, 98%

CAS: 21900-39-0 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD00236681 InChI Key: HBAQRSDZSVESSF-UHFFFAOYSA-N Synonym: 5-fluoro-2-methylbenzoylchloride,5-fluoro-2-methyl-benzoyl chloride,benzoyl chloride,5-fluoro-2-methyl,acmc-1ciaq,2-methyl-5-fluorobenzoyl chloride,5-fluoro-2-methyl benzoylchloride,5-fluoro-2-methyl benzoyl chloride,benzoyl chloride, 5-fluoro-2-methyl,5-fluoro-2-methylbenzoyl chloride PubChem CID: 2737383 IUPAC Name: 5-fluoro-2-methylbenzoyl chloride SMILES: CC1=CC=C(F)C=C1C(Cl)=O

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Specifications

PubChem CID	2737383
CAS	21900-39-0
Molecular Weight (g/mol)	172.58
MDL Number	MFCD00236681
SMILES	CC1=CC=C(F)C=C1C(Cl)=O
Synonym	5-fluoro-2-methylbenzoylchloride,5-fluoro-2-methyl-benzoyl chloride,benzoyl chloride,5-fluoro-2-methyl,acmc-1ciaq,2-methyl-5-fluorobenzoyl chloride,5-fluoro-2-methyl benzoylchloride,5-fluoro-2-methyl benzoyl chloride,benzoyl chloride, 5-fluoro-2-methyl,5-fluoro-2-methylbenzoyl chloride
IUPAC Name	5-fluoro-2-methylbenzoyl chloride
InChI Key	HBAQRSDZSVESSF-UHFFFAOYSA-N
Molecular Formula	C8H6ClFO

2,602

2-Iodobenzoic acid, 98+%

CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.019 MDL Number: MFCD00002419 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I

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Specifications

PubChem CID	6941
CAS	88-67-5
Molecular Weight (g/mol)	248.019
ChEBI	CHEBI:287979
MDL Number	MFCD00002419
SMILES	C1=CC=C(C(=C1)C(=O)O)I
Synonym	o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure
IUPAC Name	2-iodobenzoic acid
InChI Key	CJNZAXGUTKBIHP-UHFFFAOYSA-N
Molecular Formula	C7H5IO2

2,603

Salicylhydroxamic acid, 99%

CAS: 89-73-6 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 MDL Number: MFCD00002110 InChI Key: HBROZNQEVUILML-UHFFFAOYSA-N Synonym: salicylhydroxamic acid,2-hydroxybenzohydroxamic acid,salicylohydroxamic acid,sham,salicylohydroximic acid,benzamide, n,2-dihydroxy,2-hydroxybenzhydroxamic acid,o-hydroxybenzohydroxamic acid,sha,2,n-dihydroxy-benzamide PubChem CID: 66644 ChEBI: CHEBI:45615 IUPAC Name: N,2-dihydroxybenzamide SMILES: C1=CC=C(C(=C1)C(=O)NO)O

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Specifications

PubChem CID	66644
CAS	89-73-6
Molecular Weight (g/mol)	153.137
ChEBI	CHEBI:45615
MDL Number	MFCD00002110
SMILES	C1=CC=C(C(=C1)C(=O)NO)O
Synonym	salicylhydroxamic acid,2-hydroxybenzohydroxamic acid,salicylohydroxamic acid,sham,salicylohydroximic acid,benzamide, n,2-dihydroxy,2-hydroxybenzhydroxamic acid,o-hydroxybenzohydroxamic acid,sha,2,n-dihydroxy-benzamide
IUPAC Name	N,2-dihydroxybenzamide
InChI Key	HBROZNQEVUILML-UHFFFAOYSA-N
Molecular Formula	C7H7NO3

2,604

3-Fluoro-4-(methoxycarbonyl)benzeneboronic acid, 97%

CAS: 505083-04-5 Molecular Formula: C8H8BFO4 Molecular Weight (g/mol): 197.956 MDL Number: MFCD04115665 InChI Key: YZYGXFXSMDUXJT-UHFFFAOYSA-N Synonym: 3-fluoro-4-methoxycarbonyl phenyl boronic acid,3-fluoro-4-methoxycarbonyl phenylboronic acid,3-fluoro-4-methoxycarbonyl benzeneboronic acid,methyl 4-borono-2-fluorobenzoate,4-methoxycarbonyl-3-fluorophenylboronic acid,pubchem17771,3-fluoro-4-methoxycarboxyphenylboronicacid,acmc-1atlt,3-fluoro-4-methoxycarbonyl-phenyl boronic acid PubChem CID: 2782818 IUPAC Name: (3-fluoro-4-methoxycarbonylphenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)OC)F)(O)O

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PubChem CID	2782818
CAS	505083-04-5
Molecular Weight (g/mol)	197.956
MDL Number	MFCD04115665
SMILES	B(C1=CC(=C(C=C1)C(=O)OC)F)(O)O
Synonym	3-fluoro-4-methoxycarbonyl phenyl boronic acid,3-fluoro-4-methoxycarbonyl phenylboronic acid,3-fluoro-4-methoxycarbonyl benzeneboronic acid,methyl 4-borono-2-fluorobenzoate,4-methoxycarbonyl-3-fluorophenylboronic acid,pubchem17771,3-fluoro-4-methoxycarboxyphenylboronicacid,acmc-1atlt,3-fluoro-4-methoxycarbonyl-phenyl boronic acid
IUPAC Name	(3-fluoro-4-methoxycarbonylphenyl)boronic acid
InChI Key	YZYGXFXSMDUXJT-UHFFFAOYSA-N
Molecular Formula	C8H8BFO4

2,605

4-Bromo-2-methylbenzoic acid, 97%

CAS: 68837-59-2 Molecular Formula: C₈H₇BrO₂ Molecular Weight (g/mol): 215.05 InChI Key: RVCJOGNLYVNRDN-UHFFFAOYSA-N Synonym: 2-methyl-4-bromobenzoic acid,4-bromo-o-toluic acid,4-bromo-2-methyl-benzoic acid,benzoic acid, 4-bromo-2-methyl,synquest 2721-9-x6,4-bromo-2-methylbenz,4-bromo-2-methylbenzoicacid,pubchem4029,5-bromo-2-carboxytoluene,acmc-1baz5 PubChem CID: 99570 IUPAC Name: 4-bromo-2-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)Br)C(=O)O

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Specifications

PubChem CID	99570
CAS	68837-59-2
Molecular Weight (g/mol)	215.05
SMILES	CC1=C(C=CC(=C1)Br)C(=O)O
Synonym	2-methyl-4-bromobenzoic acid,4-bromo-o-toluic acid,4-bromo-2-methyl-benzoic acid,benzoic acid, 4-bromo-2-methyl,synquest 2721-9-x6,4-bromo-2-methylbenz,4-bromo-2-methylbenzoicacid,pubchem4029,5-bromo-2-carboxytoluene,acmc-1baz5
IUPAC Name	4-bromo-2-methylbenzoic acid
InChI Key	RVCJOGNLYVNRDN-UHFFFAOYSA-N
Molecular Formula	C₈H₇BrO₂

2,606

2-Bromo-6-methylbenzoic acid, 98%

CAS: 90259-31-7 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD01310788 InChI Key: ICXBPDJQFPIBSS-UHFFFAOYSA-N Synonym: 6-bromo-o-toluic acid,2-bromo-6-methyl-benzoic acid,6-bromo-2-methylbenzoic acid,benzoic acid, 2-bromo-6-methyl,bromtoluylsaure,bromotoluic acid,pubchem4715,acmc-209r5e,ksc494k9r,3-bromo-2-carboxytoluene PubChem CID: 2735589 IUPAC Name: 2-bromo-6-methylbenzoic acid SMILES: CC1=C(C(O)=O)C(Br)=CC=C1

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Specifications

PubChem CID	2735589
CAS	90259-31-7
Molecular Weight (g/mol)	215.05
MDL Number	MFCD01310788
SMILES	CC1=C(C(O)=O)C(Br)=CC=C1
Synonym	6-bromo-o-toluic acid,2-bromo-6-methyl-benzoic acid,6-bromo-2-methylbenzoic acid,benzoic acid, 2-bromo-6-methyl,bromtoluylsaure,bromotoluic acid,pubchem4715,acmc-209r5e,ksc494k9r,3-bromo-2-carboxytoluene
IUPAC Name	2-bromo-6-methylbenzoic acid
InChI Key	ICXBPDJQFPIBSS-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

2,607

2-Chloro-4-(methylsulfonyl)benzoic acid, 95%, Thermo Scientific™

CAS: 53250-83-2 Molecular Formula: C8H6ClO4S Molecular Weight (g/mol): 233.64 MDL Number: MFCD00216496 InChI Key: CTTWSFIIFMWHLQ-UHFFFAOYSA-M Synonym: 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa PubChem CID: 735863 IUPAC Name: 2-chloro-4-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1

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Specifications

PubChem CID	735863
CAS	53250-83-2
Molecular Weight (g/mol)	233.64
MDL Number	MFCD00216496
SMILES	CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1
Synonym	2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa
IUPAC Name	2-chloro-4-methylsulfonylbenzoic acid
InChI Key	CTTWSFIIFMWHLQ-UHFFFAOYSA-M
Molecular Formula	C8H6ClO4S

2,608

2-Chloro-4-nitrobenzoyl chloride, 98%

CAS: 7073-36-1 Molecular Formula: C7H3Cl2NO3 Molecular Weight (g/mol): 220.01 MDL Number: MFCD00051515 InChI Key: KTHNITVDTYAHFF-UHFFFAOYSA-N PubChem CID: 81522 IUPAC Name: 2-chloro-4-nitrobenzoyl chloride SMILES: [O-][N+](=O)C1=CC=C(C(Cl)=O)C(Cl)=C1

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Specifications

PubChem CID	81522
CAS	7073-36-1
Molecular Weight (g/mol)	220.01
MDL Number	MFCD00051515
SMILES	[O-][N+](=O)C1=CC=C(C(Cl)=O)C(Cl)=C1
IUPAC Name	2-chloro-4-nitrobenzoyl chloride
InChI Key	KTHNITVDTYAHFF-UHFFFAOYSA-N
Molecular Formula	C7H3Cl2NO3

2,609

2,5-Difluorobenzoyl chloride, 97+%

CAS: 35730-09-7 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.547 MDL Number: MFCD00009929 InChI Key: RLRUKKDFNWXXRT-UHFFFAOYSA-N Synonym: 2,5-difluorobenzoylchloride,benzoyl chloride, 2,5-difluoro,benzoyl chloride,2,5-difluoro,acmc-1afez,2,5-difluoro benzoyl chloride,2,5-difluoro-benzoyl chloride,2,5-difluorobenzoyl chloride PubChem CID: 588082 IUPAC Name: 2,5-difluorobenzoyl chloride SMILES: C1=CC(=C(C=C1F)C(=O)Cl)F

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Specifications

PubChem CID	588082
CAS	35730-09-7
Molecular Weight (g/mol)	176.547
MDL Number	MFCD00009929
SMILES	C1=CC(=C(C=C1F)C(=O)Cl)F
Synonym	2,5-difluorobenzoylchloride,benzoyl chloride, 2,5-difluoro,benzoyl chloride,2,5-difluoro,acmc-1afez,2,5-difluoro benzoyl chloride,2,5-difluoro-benzoyl chloride,2,5-difluorobenzoyl chloride
IUPAC Name	2,5-difluorobenzoyl chloride
InChI Key	RLRUKKDFNWXXRT-UHFFFAOYSA-N
Molecular Formula	C7H3ClF2O

2,610

Diatrizoic acid

CAS: 117-96-4 Molecular Formula: C11H9I3N2O4 Molecular Weight (g/mol): 613.92 MDL Number: MFCD00069960 InChI Key: YVPYQUNUQOZFHG-UHFFFAOYSA-N Synonym: diatrizoic acid,amidotrizoic acid,diatrizoate,amidotrizoate,urogranoic acid,urografin acid,odiston,urotrast,diat,diatriazoate PubChem CID: 2140 ChEBI: CHEBI:53691 IUPAC Name: 3,5-diacetamido-2,4,6-triiodobenzoic acid SMILES: CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I

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Specifications

PubChem CID	2140
CAS	117-96-4
Molecular Weight (g/mol)	613.92
ChEBI	CHEBI:53691
MDL Number	MFCD00069960
SMILES	CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I
Synonym	diatrizoic acid,amidotrizoic acid,diatrizoate,amidotrizoate,urogranoic acid,urografin acid,odiston,urotrast,diat,diatriazoate
IUPAC Name	3,5-diacetamido-2,4,6-triiodobenzoic acid
InChI Key	YVPYQUNUQOZFHG-UHFFFAOYSA-N
Molecular Formula	C11H9I3N2O4

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