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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
Hydroxybenzoic Acid Derivatives (884)
Aminobenzoic acids and derivatives (331)
Benzenesulfonamides (217)
Benzyl Derivatives (208)
Fluorobenzenes (180)
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Aniline and substituted anilines (62)
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Phthalic acid and derivatives (44)
Benzophenones (43)
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3-phenoxypropionic acids (1)
Alkyldimethylbenzylammonium halides (1)
Phenylacetaldehydes (1)

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1 – 15 of 2,931 results
1

Basic fuchsin hydrochloride, 99%, For HPLC analysis, MP Biomedicals™

CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.824 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N Synonym: basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin PubChem CID: 11292 ChEBI: CHEBI:87663 IUPAC Name: 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl

PubChem CID 11292
CAS 569-61-9
Molecular Weight (g/mol) 323.824
ChEBI CHEBI:87663
SMILES C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl
Synonym basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin
IUPAC Name 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride
InChI Key JUQPZRLQQYSMEQ-UHFFFAOYSA-N
Molecular Formula C19H18ClN3
2

1,5-Diphenylcarbazide, ≥98% (HPLC), Reag. Ph. Eur., MilliporeSigma™ Supelco™

MDL Number: MFCD00003013 Synonym: 1,5-Diphenylcarbohydrazide; sym.-Diphenylcarbazide

MDL Number MFCD00003013
Synonym 1,5-Diphenylcarbohydrazide; sym.-Diphenylcarbazide
3

2,4-Dinitrophenylhydrazine Hydrochloride 98.0+%, TCI America™

CAS: 55907-61-4 Molecular Formula: C6H7ClN4O4 Molecular Weight (g/mol): 234.60 MDL Number: MFCD00050688 InChI Key: PUYFAZQODQZOFK-UHFFFAOYSA-N PubChem CID: 5463312 IUPAC Name: hydrogen (2,4-dinitrophenyl)hydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

EDGE
PubChem CID 5463312
CAS 55907-61-4
Molecular Weight (g/mol) 234.60
MDL Number MFCD00050688
SMILES [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
IUPAC Name hydrogen (2,4-dinitrophenyl)hydrazine chloride
InChI Key PUYFAZQODQZOFK-UHFFFAOYSA-N
Molecular Formula C6H7ClN4O4
4

Benzyl Alcohol (Certified ACS), Fisher Chemical™
GSA_VA

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1

EDGE
PubChem CID 244
CAS 100-51-6
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17987
MDL Number MFCD00004599,MFCD03792087
SMILES OCC1=CC=CC=C1
Synonym benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
IUPAC Name phenylmethanol
InChI Key WVDDGKGOMKODPV-UHFFFAOYSA-N
Molecular Formula C7H8O
5

Anisole, ReagentPlus™, 99%, Solstice

CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00008354 InChI Key: RDOXTESZEPMUJZ-UHFFFAOYSA-N Synonym: methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene PubChem CID: 7519 ChEBI: CHEBI:16579 IUPAC Name: anisole SMILES: COC1=CC=CC=C1

PubChem CID 7519
CAS 100-66-3
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:16579
MDL Number MFCD00008354
SMILES COC1=CC=CC=C1
Synonym methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene
IUPAC Name anisole
InChI Key RDOXTESZEPMUJZ-UHFFFAOYSA-N
Molecular Formula C7H8O
6

4-Phenylazophenol, 98%

CAS: 1689-82-3 Molecular Formula: C12H10N2O Molecular Weight (g/mol): 198.23 MDL Number: MFCD00002330 InChI Key: JTSBGMZPPPULTA-UHFFFAOYSA-N Synonym: 4-hydroxyazobenzene,4-phenylazophenol,4-phenyldiazenyl phenol,solvent yellow 7,p-phenylazophenol,4-phenylazo phenol,p-hydroxyazobenzene,organol yellow ap,c.i. solvent yellow 7,phenol, 4-phenylazo PubChem CID: 5354198 IUPAC Name: 4-(phenylhydrazinylidene)cyclohexa-2,5-dien-1-one SMILES: O=C1C=CC(C=C1)=NNC1=CC=CC=C1

PubChem CID 5354198
CAS 1689-82-3
Molecular Weight (g/mol) 198.23
MDL Number MFCD00002330
SMILES O=C1C=CC(C=C1)=NNC1=CC=CC=C1
Synonym 4-hydroxyazobenzene,4-phenylazophenol,4-phenyldiazenyl phenol,solvent yellow 7,p-phenylazophenol,4-phenylazo phenol,p-hydroxyazobenzene,organol yellow ap,c.i. solvent yellow 7,phenol, 4-phenylazo
IUPAC Name 4-(phenylhydrazinylidene)cyclohexa-2,5-dien-1-one
InChI Key JTSBGMZPPPULTA-UHFFFAOYSA-N
Molecular Formula C12H10N2O
7

2-Aminoterephthalic acid, 98.5%, Thermo Scientific Chemicals

CAS: 10312-55-7 Molecular Formula: C8H5NO4 Molecular Weight (g/mol): 179.13 MDL Number: MFCD00134536 InChI Key: GPNNOCMCNFXRAO-UHFFFAOYSA-L Synonym: aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751 PubChem CID: 2724822 IUPAC Name: 2-aminoterephthalic acid SMILES: NC1=CC(=CC=C1C([O-])=O)C([O-])=O

PubChem CID 2724822
CAS 10312-55-7
Molecular Weight (g/mol) 179.13
MDL Number MFCD00134536
SMILES NC1=CC(=CC=C1C([O-])=O)C([O-])=O
Synonym aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751
IUPAC Name 2-aminoterephthalic acid
InChI Key GPNNOCMCNFXRAO-UHFFFAOYSA-L
Molecular Formula C8H5NO4
8

2-Fluorophenylboronic acid, 98%

CAS: 1993-03-9 Molecular Formula: C6H6BFO2 Molecular Weight (g/mol): 139.92 MDL Number: MFCD00674013 InChI Key: QCSLIRFWJPOENV-UHFFFAOYSA-N Synonym: 2-fluorophenyl boronic acid,2-fluorobenzeneboronic acid,2-fluorophenyl boranediol,o-fluorophenylboronic acid,boronic acid, b-2-fluorophenyl,boronic acid, 2-fluorophenyl,2-fluoro-phenyl-boronic acid,o-fluoro-benzeneboronic acid,benzeneboronic acid, o-fluoro PubChem CID: 2734354 IUPAC Name: (2-fluorophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1F

EDGE
PubChem CID 2734354
CAS 1993-03-9
Molecular Weight (g/mol) 139.92
MDL Number MFCD00674013
SMILES OB(O)C1=CC=CC=C1F
Synonym 2-fluorophenyl boronic acid,2-fluorobenzeneboronic acid,2-fluorophenyl boranediol,o-fluorophenylboronic acid,boronic acid, b-2-fluorophenyl,boronic acid, 2-fluorophenyl,2-fluoro-phenyl-boronic acid,o-fluoro-benzeneboronic acid,benzeneboronic acid, o-fluoro
IUPAC Name (2-fluorophenyl)boronic acid
InChI Key QCSLIRFWJPOENV-UHFFFAOYSA-N
Molecular Formula C6H6BFO2
9

2,5-Dichlorobenzoic acid, 97%

CAS: 50-79-3 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.01 MDL Number: MFCD00002416 InChI Key: QVTQYSFCFOGITD-UHFFFAOYSA-N Synonym: benzoic acid, 2,5-dichloro,unii-kp7cmr0gsd,2,5-dichlorobenzoicacid,kp7cmr0gsd,2,5-dichloro-benzoic acid,ccris 8609,pubchem3685,2,5dichlorobenzoic acid,wln: qvr bg eg,dsstox_cid_4978 PubChem CID: 5784 IUPAC Name: 2,5-dichlorobenzoic acid SMILES: OC(=O)C1=CC(Cl)=CC=C1Cl

PubChem CID 5784
CAS 50-79-3
Molecular Weight (g/mol) 191.01
MDL Number MFCD00002416
SMILES OC(=O)C1=CC(Cl)=CC=C1Cl
Synonym benzoic acid, 2,5-dichloro,unii-kp7cmr0gsd,2,5-dichlorobenzoicacid,kp7cmr0gsd,2,5-dichloro-benzoic acid,ccris 8609,pubchem3685,2,5dichlorobenzoic acid,wln: qvr bg eg,dsstox_cid_4978
IUPAC Name 2,5-dichlorobenzoic acid
InChI Key QVTQYSFCFOGITD-UHFFFAOYSA-N
Molecular Formula C7H4Cl2O2
10

2,4-Dinitrophenylhydrazine Hydrochloride 98.0+%, TCI America™

CAS: 55907-61-4 Molecular Formula: C6H7ClN4O4 Molecular Weight (g/mol): 234.60 MDL Number: MFCD00050688 InChI Key: PUYFAZQODQZOFK-UHFFFAOYSA-N PubChem CID: 5463312 IUPAC Name: hydrogen (2,4-dinitrophenyl)hydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

PubChem CID 5463312
CAS 55907-61-4
Molecular Weight (g/mol) 234.60
MDL Number MFCD00050688
SMILES [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
IUPAC Name hydrogen (2,4-dinitrophenyl)hydrazine chloride
InChI Key PUYFAZQODQZOFK-UHFFFAOYSA-N
Molecular Formula C6H7ClN4O4
11

3,3',5,5'-Tetramethylbenzidine, 99+%

CAS: 54827-17-7 Molecular Formula: C16H20N2 Molecular Weight (g/mol): 240.35 InChI Key: UAIUNKRWKOVEES-UHFFFAOYSA-N Synonym: 3,3',5,5'-tetramethylbenzidine,3,3',5,5'-tetramethyl-1,1'-biphenyl-4,4'-diamine,3,5,3',5'-tetramethylbenzidine,tmb,3,3',5,5'-tetramethyl benzidine,tmb substrate,bm blue,ccris 4727,tmb plus,tmb, insoluble PubChem CID: 41206 IUPAC Name: 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline SMILES: CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C

PubChem CID 41206
CAS 54827-17-7
Molecular Weight (g/mol) 240.35
SMILES CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C
Synonym 3,3',5,5'-tetramethylbenzidine,3,3',5,5'-tetramethyl-1,1'-biphenyl-4,4'-diamine,3,5,3',5'-tetramethylbenzidine,tmb,3,3',5,5'-tetramethyl benzidine,tmb substrate,bm blue,ccris 4727,tmb plus,tmb, insoluble
IUPAC Name 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline
InChI Key UAIUNKRWKOVEES-UHFFFAOYSA-N
Molecular Formula C16H20N2
12

4-Fluorophenylacetic acid, 98%

CAS: 405-50-5 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00004343 InChI Key: MGKPFALCNDRSQD-UHFFFAOYSA-N Synonym: 4-fluorophenylacetic acid,2-4-fluorophenyl acetic acid,p-fluorophenylacetic acid,4-fluorophenyl acetic acid,benzeneacetic acid, 4-fluoro,4-fluorobenzeneacetic acid,p-fluorophenyl acetic acid,acetic acid, p-fluorophenyl,unii-s5yjv7caz1,4-fluoro-phenyl-acetic acid PubChem CID: 9837 IUPAC Name: 2-(4-fluorophenyl)acetic acid SMILES: C1=CC(=CC=C1CC(=O)O)F

EDGE
PubChem CID 9837
CAS 405-50-5
Molecular Weight (g/mol) 154.14
MDL Number MFCD00004343
SMILES C1=CC(=CC=C1CC(=O)O)F
Synonym 4-fluorophenylacetic acid,2-4-fluorophenyl acetic acid,p-fluorophenylacetic acid,4-fluorophenyl acetic acid,benzeneacetic acid, 4-fluoro,4-fluorobenzeneacetic acid,p-fluorophenyl acetic acid,acetic acid, p-fluorophenyl,unii-s5yjv7caz1,4-fluoro-phenyl-acetic acid
IUPAC Name 2-(4-fluorophenyl)acetic acid
InChI Key MGKPFALCNDRSQD-UHFFFAOYSA-N
Molecular Formula C8H7FO2
13

Gliclazide

CAS: 21187-98-4 Molecular Formula: C15H21N3O3S Molecular Weight (g/mol): 323.41 MDL Number: MFCD00409893 InChI Key: BOVGTQGAOIONJV-UHFFFAOYNA-N Synonym: gliclazide,glimicron,diamicron,nordialex,diaikron,gliclazida,gliklazid,glyclazide,gliclazidum inn-latin,gliclazida inn-spanish PubChem CID: 3475 ChEBI: CHEBI:31654 IUPAC Name: 1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-(4-methylphenyl)sulfonylurea SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN1CC2CCCC2C1

PubChem CID 3475
CAS 21187-98-4
Molecular Weight (g/mol) 323.41
ChEBI CHEBI:31654
MDL Number MFCD00409893
SMILES CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN1CC2CCCC2C1
Synonym gliclazide,glimicron,diamicron,nordialex,diaikron,gliclazida,gliklazid,glyclazide,gliclazidum inn-latin,gliclazida inn-spanish
IUPAC Name 1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-(4-methylphenyl)sulfonylurea
InChI Key BOVGTQGAOIONJV-UHFFFAOYNA-N
Molecular Formula C15H21N3O3S
14

Diflunisal, Thermo Scientific Chemicals

CAS: 22494-42-4 Molecular Formula: C13H8F2O3 Molecular Weight (g/mol): 250.20 MDL Number: MFCD00057834 InChI Key: HUPFGZXOMWLGNK-UHFFFAOYSA-N Synonym: diflunisal,dolobid,dolobis,fluniget,flovacil,fluodonil,adomal,flustar,5-2,4-difluorophenyl salicylic acid,diflunisalum PubChem CID: 3059 ChEBI: CHEBI:39669 IUPAC Name: 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid SMILES: OC(=O)C1=CC(=CC=C1O)C1=CC=C(F)C=C1F

PubChem CID 3059
CAS 22494-42-4
Molecular Weight (g/mol) 250.20
ChEBI CHEBI:39669
MDL Number MFCD00057834
SMILES OC(=O)C1=CC(=CC=C1O)C1=CC=C(F)C=C1F
Synonym diflunisal,dolobid,dolobis,fluniget,flovacil,fluodonil,adomal,flustar,5-2,4-difluorophenyl salicylic acid,diflunisalum
IUPAC Name 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid
InChI Key HUPFGZXOMWLGNK-UHFFFAOYSA-N
Molecular Formula C13H8F2O3
15

2-Bromo-4,5-difluorobenzoic acid, 97%

CAS: 64695-84-7 Molecular Formula: C7H3BrF2O2 Molecular Weight (g/mol): 237 MDL Number: MFCD04973422 InChI Key: DGCBGBZYTNTZJH-UHFFFAOYSA-N Synonym: 2-bromo-4,5-difluorobenzoicacid,2-bromo-4,5-difluoro-benzoic acid,benzoic acid, 2-bromo-4,5-difluoro,pubchem4991,acmc-209nnq,ksc495k3l,benzoic acid,2-bromo-4,5-difluoro,2-bromo-4,5-difluorobenzoic acid,2-bromanyl-4,5-bis fluoranyl benzoic acid PubChem CID: 2782789 IUPAC Name: 2-bromo-4,5-difluorobenzoic acid SMILES: C1=C(C(=CC(=C1F)F)Br)C(=O)O

EDGE
PubChem CID 2782789
CAS 64695-84-7
Molecular Weight (g/mol) 237
MDL Number MFCD04973422
SMILES C1=C(C(=CC(=C1F)F)Br)C(=O)O
Synonym 2-bromo-4,5-difluorobenzoicacid,2-bromo-4,5-difluoro-benzoic acid,benzoic acid, 2-bromo-4,5-difluoro,pubchem4991,acmc-209nnq,ksc495k3l,benzoic acid,2-bromo-4,5-difluoro,2-bromo-4,5-difluorobenzoic acid,2-bromanyl-4,5-bis fluoranyl benzoic acid
IUPAC Name 2-bromo-4,5-difluorobenzoic acid
InChI Key DGCBGBZYTNTZJH-UHFFFAOYSA-N
Molecular Formula C7H3BrF2O2