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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.
Benzene and substituted derivatives (87,920)
Phenols (17,816)
Naphthalenes (5,659)
Phenol esters (1,991)
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Unsubstituted Phenols (1,237)
Thiophenols (635)
Anthracenes (492)
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Phenanthrenes and derivatives (359)
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Ellagic acids and derivatives (33)
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Acenaphthylenes (16)
Pentacenequinones (16)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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Keyword Search:
7,471 – 7,485 of 105,509 results
7,471

Monobutyl Phthalate 95.0+%, TCI America™

CAS: 131-70-4 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00043498 InChI Key: YZBOVSFWWNVKRJ-UHFFFAOYSA-N Synonym: Phthalic Acid Monobutyl Ester, Butyl Hydrogen Phthalate PubChem CID: 8575 IUPAC Name: 2-(butoxycarbonyl)benzoic acid SMILES: CCCCOC(=O)C1=CC=CC=C1C(O)=O

PubChem CID 8575
CAS 131-70-4
Molecular Weight (g/mol) 222.24
MDL Number MFCD00043498
SMILES CCCCOC(=O)C1=CC=CC=C1C(O)=O
Synonym Phthalic Acid Monobutyl Ester, Butyl Hydrogen Phthalate
IUPAC Name 2-(butoxycarbonyl)benzoic acid
InChI Key YZBOVSFWWNVKRJ-UHFFFAOYSA-N
Molecular Formula C12H14O4
7,472

Dicyclohexyl Phthalate 99.0+%, TCI America™

CAS: 84-61-7 Molecular Formula: C20H26O4 Molecular Weight (g/mol): 330.424 MDL Number: MFCD00003849 InChI Key: VOWAEIGWURALJQ-UHFFFAOYSA-N Synonym: dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190 PubChem CID: 6777 ChEBI: CHEBI:34693 IUPAC Name: dicyclohexyl benzene-1,2-dicarboxylate SMILES: C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3

PubChem CID 6777
CAS 84-61-7
Molecular Weight (g/mol) 330.424
ChEBI CHEBI:34693
MDL Number MFCD00003849
SMILES C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
Synonym dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190
IUPAC Name dicyclohexyl benzene-1,2-dicarboxylate
InChI Key VOWAEIGWURALJQ-UHFFFAOYSA-N
Molecular Formula C20H26O4
7,473

3-(3-Methoxyphenoxy)propionic Acid 97.0+%, TCI America™

CAS: 49855-03-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 InChI Key: JKTUZDBNDYMNLO-UHFFFAOYSA-N PubChem CID: 5201573 IUPAC Name: 3-(3-methoxyphenoxy)propanoic acid SMILES: COC1=CC(=CC=C1)OCCC(=O)O

PubChem CID 5201573
CAS 49855-03-0
Molecular Weight (g/mol) 196.202
SMILES COC1=CC(=CC=C1)OCCC(=O)O
IUPAC Name 3-(3-methoxyphenoxy)propanoic acid
InChI Key JKTUZDBNDYMNLO-UHFFFAOYSA-N
Molecular Formula C10H12O4
7,474

5-Bromo-2-fluorobenzaldehyde 95.0+%, TCI America™

CAS: 93777-26-5 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00070755 InChI Key: MMFGGDVQLQQQRX-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t PubChem CID: 736327 IUPAC Name: 5-bromo-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Br)C=O)F

PubChem CID 736327
CAS 93777-26-5
Molecular Weight (g/mol) 203.01
MDL Number MFCD00070755
SMILES C1=CC(=C(C=C1Br)C=O)F
Synonym 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t
IUPAC Name 5-bromo-2-fluorobenzaldehyde
InChI Key MMFGGDVQLQQQRX-UHFFFAOYSA-N
Molecular Formula C7H4BrFO
7,475

2,2'-Biphenyldicarboxylic Acid 98.0+%, TCI America™

CAS: 482-05-3 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00002464 InChI Key: GWZCCUDJHOGOSO-UHFFFAOYSA-N Synonym: diphenic acid,1,1'-biphenyl-2,2'-dicarboxylic acid,2,2'-biphenyldicarboxylic acid,2,2'-bibenzoic acid,biphenyl-2,2'-dicarboxylic acid,2,2'-dicarboxybiphenyl,2,2'-diphenic acid,2-2-carboxyphenyl benzoic acid,o,o'-diphenic acid,o,o'-bibenzoic acid PubChem CID: 10210 ChEBI: CHEBI:23837 IUPAC Name: 2-(2-carboxyphenyl)benzoic acid SMILES: C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)O)C(=O)O

PubChem CID 10210
CAS 482-05-3
Molecular Weight (g/mol) 242.23
ChEBI CHEBI:23837
MDL Number MFCD00002464
SMILES C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)O)C(=O)O
Synonym diphenic acid,1,1'-biphenyl-2,2'-dicarboxylic acid,2,2'-biphenyldicarboxylic acid,2,2'-bibenzoic acid,biphenyl-2,2'-dicarboxylic acid,2,2'-dicarboxybiphenyl,2,2'-diphenic acid,2-2-carboxyphenyl benzoic acid,o,o'-diphenic acid,o,o'-bibenzoic acid
IUPAC Name 2-(2-carboxyphenyl)benzoic acid
InChI Key GWZCCUDJHOGOSO-UHFFFAOYSA-N
Molecular Formula C14H10O4
7,476

Dinonyl Phthalate (mixture of isomers) 95.0+%, TCI America™

CAS: 84-76-4 Molecular Formula: C26H42O4 Molecular Weight (g/mol): 418.62 MDL Number: MFCD00036237 InChI Key: DROMNWUQASBTFM-UHFFFAOYSA-N Synonym: dinonyl phthalate,dinonylphthalate,nonyl phthalate,di-n-nonyl phthalate,bisoflex dnp,unimoll dn,bisoflex 91,phthalic acid, dinonyl ester,1,2-benzenedicarboxylic acid, dinonyl ester,bisolflex 91 PubChem CID: 6787 IUPAC Name: 1,2-dinonyl benzene-1,2-dicarboxylate SMILES: CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC

PubChem CID 6787
CAS 84-76-4
Molecular Weight (g/mol) 418.62
MDL Number MFCD00036237
SMILES CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC
Synonym dinonyl phthalate,dinonylphthalate,nonyl phthalate,di-n-nonyl phthalate,bisoflex dnp,unimoll dn,bisoflex 91,phthalic acid, dinonyl ester,1,2-benzenedicarboxylic acid, dinonyl ester,bisolflex 91
IUPAC Name 1,2-dinonyl benzene-1,2-dicarboxylate
InChI Key DROMNWUQASBTFM-UHFFFAOYSA-N
Molecular Formula C26H42O4
7,477

4-n-Octylbenzoic Acid 97.0+%, TCI America™

CAS: 3575-31-3 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00042649 InChI Key: ZQLDNJKHLQOJGE-UHFFFAOYSA-N Synonym: 4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984 PubChem CID: 19147 IUPAC Name: 4-octylbenzoic acid SMILES: CCCCCCCCC1=CC=C(C=C1)C(=O)O

PubChem CID 19147
CAS 3575-31-3
Molecular Weight (g/mol) 234.339
MDL Number MFCD00042649
SMILES CCCCCCCCC1=CC=C(C=C1)C(=O)O
Synonym 4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984
IUPAC Name 4-octylbenzoic acid
InChI Key ZQLDNJKHLQOJGE-UHFFFAOYSA-N
Molecular Formula C15H22O2
7,478

1,4-Diphenyl-2-butyne-1,4-dione 96.0+%, TCI America™

CAS: 1087-09-8 Molecular Formula: C16H10O2 Molecular Weight (g/mol): 234.254 InChI Key: BLCJVQFFSUNDMV-UHFFFAOYSA-N Synonym: Dibenzoylacetylene PubChem CID: 227980 IUPAC Name: 1,4-diphenylbut-2-yne-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)C#CC(=O)C2=CC=CC=C2

PubChem CID 227980
CAS 1087-09-8
Molecular Weight (g/mol) 234.254
SMILES C1=CC=C(C=C1)C(=O)C#CC(=O)C2=CC=CC=C2
Synonym Dibenzoylacetylene
IUPAC Name 1,4-diphenylbut-2-yne-1,4-dione
InChI Key BLCJVQFFSUNDMV-UHFFFAOYSA-N
Molecular Formula C16H10O2
7,479

Ethyl 4-Cyanobenzoate 98.0+%, TCI America™

CAS: 7153-22-2 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00001824 InChI Key: JLSSWDFCYXSLQX-UHFFFAOYSA-N Synonym: benzoic acid, 4-cyano-, ethyl ester,4-cyanobenzoic acid ethyl ester,benzoic acid, 4-cyano-,ethyl ester,4-cyano-benzoic acid ethyl ester,ethyl p-cyanobenzoate,ethyl-4-cyanobenzoate,p-cyano ethyl benzoate,acmc-209ypo,ethyl 4-cyanobenzoate,4-cyanobenzoic acid, ethyl ester PubChem CID: 81589 IUPAC Name: ethyl 4-cyanobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C#N

PubChem CID 81589
CAS 7153-22-2
Molecular Weight (g/mol) 175.19
MDL Number MFCD00001824
SMILES CCOC(=O)C1=CC=C(C=C1)C#N
Synonym benzoic acid, 4-cyano-, ethyl ester,4-cyanobenzoic acid ethyl ester,benzoic acid, 4-cyano-,ethyl ester,4-cyano-benzoic acid ethyl ester,ethyl p-cyanobenzoate,ethyl-4-cyanobenzoate,p-cyano ethyl benzoate,acmc-209ypo,ethyl 4-cyanobenzoate,4-cyanobenzoic acid, ethyl ester
IUPAC Name ethyl 4-cyanobenzoate
InChI Key JLSSWDFCYXSLQX-UHFFFAOYSA-N
Molecular Formula C10H9NO2
7,480

4-Chloro-3-fluorobenzaldehyde 97.0+%, TCI America™

CAS: 5527-95-7 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.556 MDL Number: MFCD00143288 InChI Key: AZMDWRPTDCIFRD-UHFFFAOYSA-N Synonym: 3-fluoro-4-chlorobenzaldehyde,4-chloro-3-fluorobenz-aldehyde,4-chloro-3-fluoro-benzaldehyde,benzaldehyde, 4-chloro-3-fluoro,pubchem1412,acmc-1amt7,ksc494a8n,4-chloro-3-fluoro benzaldehyde,azmdwrptdcifrd-uhfffaoysa PubChem CID: 2724985 IUPAC Name: 4-chloro-3-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)F)Cl

PubChem CID 2724985
CAS 5527-95-7
Molecular Weight (g/mol) 158.556
MDL Number MFCD00143288
SMILES C1=CC(=C(C=C1C=O)F)Cl
Synonym 3-fluoro-4-chlorobenzaldehyde,4-chloro-3-fluorobenz-aldehyde,4-chloro-3-fluoro-benzaldehyde,benzaldehyde, 4-chloro-3-fluoro,pubchem1412,acmc-1amt7,ksc494a8n,4-chloro-3-fluoro benzaldehyde,azmdwrptdcifrd-uhfffaoysa
IUPAC Name 4-chloro-3-fluorobenzaldehyde
InChI Key AZMDWRPTDCIFRD-UHFFFAOYSA-N
Molecular Formula C7H4ClFO
7,481

Isobutyl Benzoate 99.0+%, TCI America™

CAS: 120-50-3 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00048344 InChI Key: KYZHGEFMXZOSJN-UHFFFAOYSA-N Synonym: isobutyl benzoate,benzoic acid, isobutyl ester,benzoic acid, 2-methylpropyl ester,unii-kq6xz9wjii,isobutyl benzoate natural,fema no. 2185,kq6xz9wjii,benzoic acid isobutyl ester,benzoic acid, isobutyl ester 6ci,7ci,8ci,iso-butyl benzoate PubChem CID: 61048 ChEBI: CHEBI:87500 IUPAC Name: 2-methylpropyl benzoate SMILES: CC(C)COC(=O)C1=CC=CC=C1

PubChem CID 61048
CAS 120-50-3
Molecular Weight (g/mol) 178.23
ChEBI CHEBI:87500
MDL Number MFCD00048344
SMILES CC(C)COC(=O)C1=CC=CC=C1
Synonym isobutyl benzoate,benzoic acid, isobutyl ester,benzoic acid, 2-methylpropyl ester,unii-kq6xz9wjii,isobutyl benzoate natural,fema no. 2185,kq6xz9wjii,benzoic acid isobutyl ester,benzoic acid, isobutyl ester 6ci,7ci,8ci,iso-butyl benzoate
IUPAC Name 2-methylpropyl benzoate
InChI Key KYZHGEFMXZOSJN-UHFFFAOYSA-N
Molecular Formula C11H14O2
7,482

2-Bromo-5-chlorobenzaldehyde 97.0+%, TCI America™

CAS: 174265-12-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 InChI Key: IIISHLMCTDMUHH-UHFFFAOYSA-N Synonym: 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa PubChem CID: 15391279 IUPAC Name: 2-bromo-5-chlorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)Br

PubChem CID 15391279
CAS 174265-12-4
Molecular Weight (g/mol) 219.462
SMILES C1=CC(=C(C=C1Cl)C=O)Br
Synonym 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa
IUPAC Name 2-bromo-5-chlorobenzaldehyde
InChI Key IIISHLMCTDMUHH-UHFFFAOYSA-N
Molecular Formula C7H4BrClO
7,483

Diisobutyl Phthalate 98.0+%, TCI America™

CAS: 84-69-5 Molecular Formula: C16H22O4 Molecular Weight (g/mol): 278.35 MDL Number: MFCD00026480 InChI Key: MGWAVDBGNNKXQV-UHFFFAOYSA-N Synonym: diisobutyl phthalate,palatinol ic,dibp,isobutyl phthalate,hexaplas m/1b,kodaflex dibp,di-iso-butyl phthalate,phthalic acid, diisobutyl ester,phthalic acid diisobutyl ester,di i-butyl phthalate PubChem CID: 6782 ChEBI: CHEBI:79053 IUPAC Name: 1,2-bis(2-methylpropyl) benzene-1,2-dicarboxylate SMILES: CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C

PubChem CID 6782
CAS 84-69-5
Molecular Weight (g/mol) 278.35
ChEBI CHEBI:79053
MDL Number MFCD00026480
SMILES CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C
Synonym diisobutyl phthalate,palatinol ic,dibp,isobutyl phthalate,hexaplas m/1b,kodaflex dibp,di-iso-butyl phthalate,phthalic acid, diisobutyl ester,phthalic acid diisobutyl ester,di i-butyl phthalate
IUPAC Name 1,2-bis(2-methylpropyl) benzene-1,2-dicarboxylate
InChI Key MGWAVDBGNNKXQV-UHFFFAOYSA-N
Molecular Formula C16H22O4
7,484

Terephthalaldehyde 98.0+%, TCI America™

CAS: 623-27-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.134 MDL Number: MFCD00006949 InChI Key: KUCOHFSKRZZVRO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde PubChem CID: 12173 IUPAC Name: terephthalaldehyde SMILES: C1=CC(=CC=C1C=O)C=O

PubChem CID 12173
CAS 623-27-8
Molecular Weight (g/mol) 134.134
MDL Number MFCD00006949
SMILES C1=CC(=CC=C1C=O)C=O
Synonym 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde
IUPAC Name terephthalaldehyde
InChI Key KUCOHFSKRZZVRO-UHFFFAOYSA-N
Molecular Formula C8H6O2
7,485

2-(p-Tolyl)benzoic Acid 98.0+%, TCI America™

CAS: 7148-03-0 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00045826 InChI Key: ZSTUEICKYWFYIC-UHFFFAOYSA-N PubChem CID: 81568 IUPAC Name: 2-(4-methylphenyl)benzoic acid SMILES: CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

PubChem CID 81568
CAS 7148-03-0
Molecular Weight (g/mol) 212.248
MDL Number MFCD00045826
SMILES CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)O
IUPAC Name 2-(4-methylphenyl)benzoic acid
InChI Key ZSTUEICKYWFYIC-UHFFFAOYSA-N
Molecular Formula C14H12O2