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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 (44,067)
Aminobenzoic acids and derivatives (12,879)
Benzyl Derivatives (11,372)
Methoxybenzoic acids and derivatives (6,892)
Fluorobenzenes (4,976)
Phenylpropenes (4,933)
Phenoxy compounds (3,058)
Methoxybenzenes (2,709)
Aniline and substituted anilines (2,482)
Trifluoromethylbenzenes (2,334)
Bromobenzenes (2,225)
Sulfanylbenzoic acids and derivatives (2,208)
Phenylmethylamines (1,975)
Phenylphosphines and derivatives (1,891)
Benzoyl derivatives (1,886)
Phenylhydrazines (1,833)
Benzenesulfonamides (1,721)
Phenylcarbamic acid esters (1,711)
Benzoic acids (1,558)
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Nitrobenzoic acids and derivatives (1,308)
Diphenylmethanes (1,058)
Benzoic acid esters (1,048)
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3-phenoxypropionic acids (34)
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Toluene diisocyanates (15)
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1 2-Dihalobenzenes (9)
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1,276 – 1,290 of 119,425 results
1,276
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o-Toluic acid, 98+%

CAS: 118-90-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002477 InChI Key: ZWLPBLYKEWSWPD-UHFFFAOYSA-N Synonym: o-toluic acid,o-toluylic acid,orthotoluic acid,2-toluic acid,toluic acid,benzoic acid, 2-methyl,o-methylbenzoic acid,2-methyl-benzoic acid,benzoic acid, methyl,o-toluate PubChem CID: 8373 ChEBI: CHEBI:36632 IUPAC Name: 2-methylbenzoic acid SMILES: CC1=CC=CC=C1C(=O)O

PubChem CID 8373
CAS 118-90-1
Molecular Weight (g/mol) 136.15
ChEBI CHEBI:36632
MDL Number MFCD00002477
SMILES CC1=CC=CC=C1C(=O)O
Synonym o-toluic acid,o-toluylic acid,orthotoluic acid,2-toluic acid,toluic acid,benzoic acid, 2-methyl,o-methylbenzoic acid,2-methyl-benzoic acid,benzoic acid, methyl,o-toluate
IUPAC Name 2-methylbenzoic acid
InChI Key ZWLPBLYKEWSWPD-UHFFFAOYSA-N
Molecular Formula C8H8O2
1,277
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Methyl Benzoylformate, Spectrum™ Chemical

CAS: 15206-55-0

CAS 15206-55-0
1,278
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5-Bromo-2-chlorobenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 189628-37-3 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.46 MDL Number: MFCD08445659 InChI Key: DPKKRQAEYWOISP-UHFFFAOYSA-N PubChem CID: 10608925 IUPAC Name: 5-bromo-2-chlorobenzaldehyde SMILES: ClC1=C(C=O)C=C(Br)C=C1

PubChem CID 10608925
CAS 189628-37-3
Molecular Weight (g/mol) 219.46
MDL Number MFCD08445659
SMILES ClC1=C(C=O)C=C(Br)C=C1
IUPAC Name 5-bromo-2-chlorobenzaldehyde
InChI Key DPKKRQAEYWOISP-UHFFFAOYSA-N
Molecular Formula C7H4BrClO
1,279
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2-Cyclohexylbenzoic acid, 97%

CAS: 97023-48-8 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00452653 InChI Key: ZKTFZNPTAJIXMK-UHFFFAOYSA-N Synonym: benzoic acid, 2-cyclohexyl,cyclohexylbenzoic acid,2-cyclohexyl benzoic acid,2-cyclohexyl-benzoic acid PubChem CID: 7020572 IUPAC Name: 2-cyclohexylbenzoic acid SMILES: C1CCC(CC1)C2=CC=CC=C2C(=O)O

PubChem CID 7020572
CAS 97023-48-8
Molecular Weight (g/mol) 204.269
MDL Number MFCD00452653
SMILES C1CCC(CC1)C2=CC=CC=C2C(=O)O
Synonym benzoic acid, 2-cyclohexyl,cyclohexylbenzoic acid,2-cyclohexyl benzoic acid,2-cyclohexyl-benzoic acid
IUPAC Name 2-cyclohexylbenzoic acid
InChI Key ZKTFZNPTAJIXMK-UHFFFAOYSA-N
Molecular Formula C13H16O2
1,280
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4-Chloro-2-fluorobenzaldehyde, 99%

CAS: 61072-56-8 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 InChI Key: UVGYSEIWAOOIJR-UHFFFAOYSA-N Synonym: 2-fluoro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-2-fluoro,4-chloranyl-2-fluoranyl-benzaldehyde,pubchem1435,acmc-1b5ai,ksc494c2f,3-fluoro-4-formylchlorobenzene,4-chloro-2-fluoro-benzaldehyde,4-chloro-2-fluoro-benzoaldehyde,timtec-bb sbb003985 PubChem CID: 2724908 IUPAC Name: 4-chloro-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)F)C=O

PubChem CID 2724908
CAS 61072-56-8
Molecular Weight (g/mol) 158.56
SMILES C1=CC(=C(C=C1Cl)F)C=O
Synonym 2-fluoro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-2-fluoro,4-chloranyl-2-fluoranyl-benzaldehyde,pubchem1435,acmc-1b5ai,ksc494c2f,3-fluoro-4-formylchlorobenzene,4-chloro-2-fluoro-benzaldehyde,4-chloro-2-fluoro-benzoaldehyde,timtec-bb sbb003985
IUPAC Name 4-chloro-2-fluorobenzaldehyde
InChI Key UVGYSEIWAOOIJR-UHFFFAOYSA-N
Molecular Formula C7H4ClFO
1,281
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Benzoic Acid, Crystal, Reagent, ACS, 99.5%, Spectrum™ Chemical

CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.12 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N IUPAC Name: benzoic acid SMILES: OC(=O)C1=CC=CC=C1

CAS 65-85-0
Molecular Weight (g/mol) 122.12
SMILES OC(=O)C1=CC=CC=C1
IUPAC Name benzoic acid
InChI Key WPYMKLBDIGXBTP-UHFFFAOYSA-N
Molecular Formula C7H6O2
1,282
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2,4-Dimethylbenzaldehyde, 90+%

CAS: 15764-16-6 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00003340 InChI Key: GISVICWQYMUPJF-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4-dimethyl,2,4-dimethyl benzaldehyde,2,4-xylylaldehyde,2,4-dimethylbenzenecarboxaldehyde,unii-i06yu18h4a,1-formyl-2,4-dimethylbenzene,2,4-dimethyl-benzaldehyde,m-xylylaldehyde,fema no. 3427,2,4-trimethyl benzaldehyde PubChem CID: 61814 IUPAC Name: 2,4-dimethylbenzaldehyde SMILES: CC1=CC(=C(C=C1)C=O)C

PubChem CID 61814
CAS 15764-16-6
Molecular Weight (g/mol) 134.178
MDL Number MFCD00003340
SMILES CC1=CC(=C(C=C1)C=O)C
Synonym benzaldehyde, 2,4-dimethyl,2,4-dimethyl benzaldehyde,2,4-xylylaldehyde,2,4-dimethylbenzenecarboxaldehyde,unii-i06yu18h4a,1-formyl-2,4-dimethylbenzene,2,4-dimethyl-benzaldehyde,m-xylylaldehyde,fema no. 3427,2,4-trimethyl benzaldehyde
IUPAC Name 2,4-dimethylbenzaldehyde
InChI Key GISVICWQYMUPJF-UHFFFAOYSA-N
Molecular Formula C9H10O
1,283
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4-Fluorobenzaldehyde, 98+%

CAS: 459-57-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.11 MDL Number: MFCD00003378 InChI Key: UOQXIWFBQSVDPP-UHFFFAOYSA-N Synonym: p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde PubChem CID: 68023 IUPAC Name: 4-fluorobenzaldehyde SMILES: C1=CC(=CC=C1C=O)F

PubChem CID 68023
CAS 459-57-4
Molecular Weight (g/mol) 124.11
MDL Number MFCD00003378
SMILES C1=CC(=CC=C1C=O)F
Synonym p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde
IUPAC Name 4-fluorobenzaldehyde
InChI Key UOQXIWFBQSVDPP-UHFFFAOYSA-N
Molecular Formula C7H5FO
1,284
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2,4,6-Trimethoxybenzaldehyde, 98%

CAS: 830-79-5 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.2 MDL Number: MFCD00003313 InChI Key: CRBZVDLXAIFERF-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene PubChem CID: 70019 IUPAC Name: 2,4,6-trimethoxybenzaldehyde SMILES: COC1=CC(=C(C(=C1)OC)C=O)OC

PubChem CID 70019
CAS 830-79-5
Molecular Weight (g/mol) 196.2
MDL Number MFCD00003313
SMILES COC1=CC(=C(C(=C1)OC)C=O)OC
Synonym benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene
IUPAC Name 2,4,6-trimethoxybenzaldehyde
InChI Key CRBZVDLXAIFERF-UHFFFAOYSA-N
Molecular Formula C10H12O4
1,285
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4-Formylbenzeneboronic acid, 97%

CAS: 87199-17-5 Molecular Formula: C7H7BO3 Molecular Weight (g/mol): 149.94 MDL Number: MFCD00151823 InChI Key: VXWBQOJISHAKKM-UHFFFAOYSA-N Synonym: 4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid PubChem CID: 591073 IUPAC Name: (4-formylphenyl)boronic acid SMILES: OB(O)C1=CC=C(C=O)C=C1

PubChem CID 591073
CAS 87199-17-5
Molecular Weight (g/mol) 149.94
MDL Number MFCD00151823
SMILES OB(O)C1=CC=C(C=O)C=C1
Synonym 4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid
IUPAC Name (4-formylphenyl)boronic acid
InChI Key VXWBQOJISHAKKM-UHFFFAOYSA-N
Molecular Formula C7H7BO3
1,286

Selectophore™ Bis(2-ethylhexyl) phthalate, MilliporeSigma™ Supelco™

MDL Number: MFCD00009493 Synonym: DEHP; Phthalic acid bis(2-ethylhexyl ester); ′Dioctyl′ phthalate

MDL Number MFCD00009493
Synonym DEHP; Phthalic acid bis(2-ethylhexyl ester); ′Dioctyl′ phthalate
1,287

4-(1,3-Thiazol-2-yl)benzaldehyde, 95%, Thermo Scientific™

CAS: 198904-53-9 Molecular Formula: C10H7NOS Molecular Weight (g/mol): 189.23 MDL Number: MFCD06797780 InChI Key: LQLBILPEELCFQI-UHFFFAOYSA-N PubChem CID: 10535655 IUPAC Name: 4-(1,3-thiazol-2-yl)benzaldehyde SMILES: O=CC1=CC=C(C=C1)C1=NC=CS1

PubChem CID 10535655
CAS 198904-53-9
Molecular Weight (g/mol) 189.23
MDL Number MFCD06797780
SMILES O=CC1=CC=C(C=C1)C1=NC=CS1
IUPAC Name 4-(1,3-thiazol-2-yl)benzaldehyde
InChI Key LQLBILPEELCFQI-UHFFFAOYSA-N
Molecular Formula C10H7NOS
1,288
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3-(1H-Tetrazol-5-yl)benzoic acid, 97%

CAS: 73096-39-6 Molecular Formula: C8H6N4O2 Molecular Weight (g/mol): 190.162 MDL Number: MFCD03821131 InChI Key: MIERACSHCALJOM-UHFFFAOYSA-N Synonym: 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid PubChem CID: 333942 IUPAC Name: 3-(2H-tetrazol-5-yl)benzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2

PubChem CID 333942
CAS 73096-39-6
Molecular Weight (g/mol) 190.162
MDL Number MFCD03821131
SMILES C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2
Synonym 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid
IUPAC Name 3-(2H-tetrazol-5-yl)benzoic acid
InChI Key MIERACSHCALJOM-UHFFFAOYSA-N
Molecular Formula C8H6N4O2
1,289
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2-Ethylbenzoic acid, 97%

CAS: 612-19-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00045838 InChI Key: CGMMPMYKMDITEA-UHFFFAOYSA-N Synonym: benzoic acid, ethyl,o-ethylbenzoic acid,2-ethylbenzoicacidethylester,ethylbenzoic acid,pubchem9869,2-ethyl-benzoic acid,benzoic acid,2-ethyl,benzoic acid, 2-ethyl,acmc-1ax4g,2-ethylbenzoic acid PubChem CID: 34170 IUPAC Name: 2-ethylbenzoic acid SMILES: CCC1=CC=CC=C1C(=O)O

PubChem CID 34170
CAS 612-19-1
Molecular Weight (g/mol) 150.18
MDL Number MFCD00045838
SMILES CCC1=CC=CC=C1C(=O)O
Synonym benzoic acid, ethyl,o-ethylbenzoic acid,2-ethylbenzoicacidethylester,ethylbenzoic acid,pubchem9869,2-ethyl-benzoic acid,benzoic acid,2-ethyl,benzoic acid, 2-ethyl,acmc-1ax4g,2-ethylbenzoic acid
IUPAC Name 2-ethylbenzoic acid
InChI Key CGMMPMYKMDITEA-UHFFFAOYSA-N
Molecular Formula C9H10O2
1,290
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Biphenyl-4-carboxylic acid, 98%

CAS: 92-92-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00002553 InChI Key: NNJMFJSKMRYHSR-UHFFFAOYSA-N Synonym: 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl PubChem CID: 66724 IUPAC Name: 4-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

PubChem CID 66724
CAS 92-92-2
Molecular Weight (g/mol) 198.221
MDL Number MFCD00002553
SMILES C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
Synonym 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl
IUPAC Name 4-phenylbenzoic acid
InChI Key NNJMFJSKMRYHSR-UHFFFAOYSA-N
Molecular Formula C13H10O2