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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 (67,940)
Phenols (13,626)
Naphthalenes (5,098)
Fluorenes (1,235)
Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (419)
Phenanthrenes and derivatives (332)
Tetralins (327)
Indanes (313)
Triphenyl compounds (278)
Pyrenes (229)
Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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3,601 – 3,615 of 79,012 results
3,601

2-Benzyloxybenzoic acid, 98%

CAS: 14389-86-7 Molecular Formula: C14H11O3 Molecular Weight (g/mol): 227.24 MDL Number: MFCD00051940 InChI Key: GMOYUTKNPLBTMT-UHFFFAOYSA-M PubChem CID: 1810581 SMILES: [O-]C(=O)C1=CC=CC=C1OCC1=CC=CC=C1

PubChem CID 1810581
CAS 14389-86-7
Molecular Weight (g/mol) 227.24
MDL Number MFCD00051940
SMILES [O-]C(=O)C1=CC=CC=C1OCC1=CC=CC=C1
InChI Key GMOYUTKNPLBTMT-UHFFFAOYSA-M
Molecular Formula C14H11O3
3,602

Ethyl 4-nitrobenzoate, 98%

CAS: 99-77-4 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00007351 InChI Key: PHWSCBWNPZDYRI-UHFFFAOYSA-N Synonym: ethyl p-nitrobenzoate,benzoic acid, 4-nitro-, ethyl ester,4-nitrobenzoic acid ethyl ester,ethyl nitrobenzoate, para ester,p-nitrobenzoic acid, ethyl ester,4-ethoxycarbonyl nitrobenzene,benzoic acid, p-nitro-, ethyl ester,ethyl-p-nitrobenzoate,unii-1och6y8nar,ethyl para-nitrobenzoate PubChem CID: 7457 IUPAC Name: ethyl 4-nitrobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 7457
CAS 99-77-4
Molecular Weight (g/mol) 195.174
MDL Number MFCD00007351
SMILES CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Synonym ethyl p-nitrobenzoate,benzoic acid, 4-nitro-, ethyl ester,4-nitrobenzoic acid ethyl ester,ethyl nitrobenzoate, para ester,p-nitrobenzoic acid, ethyl ester,4-ethoxycarbonyl nitrobenzene,benzoic acid, p-nitro-, ethyl ester,ethyl-p-nitrobenzoate,unii-1och6y8nar,ethyl para-nitrobenzoate
IUPAC Name ethyl 4-nitrobenzoate
InChI Key PHWSCBWNPZDYRI-UHFFFAOYSA-N
Molecular Formula C9H9NO4
3,603

4-Fluorobenzoic acid, 98%

CAS: 456-22-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002530 InChI Key: BBYDXOIZLAWGSL-UHFFFAOYSA-N Synonym: p-fluorobenzoic acid,benzoic acid, 4-fluoro,para-fluorobenzoic acid,4-fluoro-benzoic acid,benzoic acid, p-fluoro,unii-v5roo2hou4,p-fluoro-benzoic acid,v5roo2hou4,4-fluorobenzoatd,p-flurobenzoic acid PubChem CID: 9973 ChEBI: CHEBI:20364 IUPAC Name: 4-fluorobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)F

PubChem CID 9973
CAS 456-22-4
Molecular Weight (g/mol) 140.113
ChEBI CHEBI:20364
MDL Number MFCD00002530
SMILES C1=CC(=CC=C1C(=O)O)F
Synonym p-fluorobenzoic acid,benzoic acid, 4-fluoro,para-fluorobenzoic acid,4-fluoro-benzoic acid,benzoic acid, p-fluoro,unii-v5roo2hou4,p-fluoro-benzoic acid,v5roo2hou4,4-fluorobenzoatd,p-flurobenzoic acid
IUPAC Name 4-fluorobenzoic acid
InChI Key BBYDXOIZLAWGSL-UHFFFAOYSA-N
Molecular Formula C7H5FO2
3,604

1,3-Dimethoxybenzene, 98%

CAS: 151-10-0 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008384 InChI Key: DPZNOMCNRMUKPS-UHFFFAOYSA-N Synonym: m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu PubChem CID: 9025 IUPAC Name: 1,3-dimethoxybenzene SMILES: COC1=CC(OC)=CC=C1

PubChem CID 9025
CAS 151-10-0
Molecular Weight (g/mol) 138.17
MDL Number MFCD00008384
SMILES COC1=CC(OC)=CC=C1
Synonym m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu
IUPAC Name 1,3-dimethoxybenzene
InChI Key DPZNOMCNRMUKPS-UHFFFAOYSA-N
Molecular Formula C8H10O2
3,605

3-Nitrobenzoic acid, 99%

CAS: 121-92-6 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007251 InChI Key: AFPHTEQTJZKQAQ-UHFFFAOYSA-N Synonym: 3-nitrobenzoic acid,m-nitrobenzoic acid,benzoic acid, 3-nitro,benzoic acid, m-nitro,meta-nitrobenzoic acid,metanitrobenzoic acid,m-nitrobenzenecarboxylic acid,3-nitro-benzoic acid,ccris 2335,nitrobenzoic 3-acid PubChem CID: 8497 SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O

PubChem CID 8497
CAS 121-92-6
Molecular Weight (g/mol) 167.12
MDL Number MFCD00007251
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
Synonym 3-nitrobenzoic acid,m-nitrobenzoic acid,benzoic acid, 3-nitro,benzoic acid, m-nitro,meta-nitrobenzoic acid,metanitrobenzoic acid,m-nitrobenzenecarboxylic acid,3-nitro-benzoic acid,ccris 2335,nitrobenzoic 3-acid
InChI Key AFPHTEQTJZKQAQ-UHFFFAOYSA-N
Molecular Formula C7H5NO4
3,606

4-Bromo-3-methylbenzamide, 99%

CAS: 170229-98-8 Molecular Formula: C8H8BrNO Molecular Weight (g/mol): 214.062 MDL Number: MFCD00672914 InChI Key: ZPFPOZMNEKPBIF-UHFFFAOYSA-N Synonym: benzamide,4-bromo-3-methyl,pubchem3804,4-bromo-3-methyl-benzamide,acmc-1c5o5,4-bromanyl-3-methyl-benzamide PubChem CID: 7020869 IUPAC Name: 4-bromo-3-methylbenzamide SMILES: CC1=C(C=CC(=C1)C(=O)N)Br

PubChem CID 7020869
CAS 170229-98-8
Molecular Weight (g/mol) 214.062
MDL Number MFCD00672914
SMILES CC1=C(C=CC(=C1)C(=O)N)Br
Synonym benzamide,4-bromo-3-methyl,pubchem3804,4-bromo-3-methyl-benzamide,acmc-1c5o5,4-bromanyl-3-methyl-benzamide
IUPAC Name 4-bromo-3-methylbenzamide
InChI Key ZPFPOZMNEKPBIF-UHFFFAOYSA-N
Molecular Formula C8H8BrNO
3,607

Toluene-2,6-diisocyanate, 97%

CAS: 91-08-7 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002010 InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N Synonym: 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene PubChem CID: 7040 ChEBI: CHEBI:53557 IUPAC Name: 1,3-diisocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1N=C=O)N=C=O

PubChem CID 7040
CAS 91-08-7
Molecular Weight (g/mol) 174.159
ChEBI CHEBI:53557
MDL Number MFCD00002010
SMILES CC1=C(C=CC=C1N=C=O)N=C=O
Synonym 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene
IUPAC Name 1,3-diisocyanato-2-methylbenzene
InChI Key RUELTTOHQODFPA-UHFFFAOYSA-N
Molecular Formula C9H6N2O2
3,608

2-Bromo-1,4-difluorobenzene, 98%

CAS: 399-94-0 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.991 MDL Number: MFCD00000345 InChI Key: XCRCSPKQEDMVBO-UHFFFAOYSA-N Synonym: 1-bromo-2,5-difluorobenzene,2,5-difluorobromobenzene,benzene, 2-bromo-1,4-difluoro,1,4-difluoro-2-bromobenzene,2-bromo-1,4-difluoro-benzene,fr df be,pubchem2302,acmc-1ad5i,1-bromo-2,5 difluorobenzene,2,5-difluoro-1-bromobenzene PubChem CID: 67862 IUPAC Name: 2-bromo-1,4-difluorobenzene SMILES: C1=CC(=C(C=C1F)Br)F

PubChem CID 67862
CAS 399-94-0
Molecular Weight (g/mol) 192.991
MDL Number MFCD00000345
SMILES C1=CC(=C(C=C1F)Br)F
Synonym 1-bromo-2,5-difluorobenzene,2,5-difluorobromobenzene,benzene, 2-bromo-1,4-difluoro,1,4-difluoro-2-bromobenzene,2-bromo-1,4-difluoro-benzene,fr df be,pubchem2302,acmc-1ad5i,1-bromo-2,5 difluorobenzene,2,5-difluoro-1-bromobenzene
IUPAC Name 2-bromo-1,4-difluorobenzene
InChI Key XCRCSPKQEDMVBO-UHFFFAOYSA-N
Molecular Formula C6H3BrF2
3,609

4-Methoxytrityl chloride, 97%

CAS: 14470-28-1 Molecular Formula: C20H17ClO Molecular Weight (g/mol): 308.805 MDL Number: MFCD00000814 InChI Key: OBOHMJWDFPBPKD-UHFFFAOYSA-N Synonym: 4-methoxytriphenylchloromethane,4-methoxytrityl chloride,4-methoxytriphenylmethyl chloride,4-monomethoxytrityl chloride,mmtrcl,p-chlorodiphenylmethyl anisole,p-anisylchlorodiphenylmethane,1-chlorodiphenylmethyl-4-methoxybenzene,chloro 4-methoxyphenyl methylene dibenzene,4-methoxytritylchloride PubChem CID: 84462 IUPAC Name: 1-[chloro(diphenyl)methyl]-4-methoxybenzene SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl

PubChem CID 84462
CAS 14470-28-1
Molecular Weight (g/mol) 308.805
MDL Number MFCD00000814
SMILES COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl
Synonym 4-methoxytriphenylchloromethane,4-methoxytrityl chloride,4-methoxytriphenylmethyl chloride,4-monomethoxytrityl chloride,mmtrcl,p-chlorodiphenylmethyl anisole,p-anisylchlorodiphenylmethane,1-chlorodiphenylmethyl-4-methoxybenzene,chloro 4-methoxyphenyl methylene dibenzene,4-methoxytritylchloride
IUPAC Name 1-[chloro(diphenyl)methyl]-4-methoxybenzene
InChI Key OBOHMJWDFPBPKD-UHFFFAOYSA-N
Molecular Formula C20H17ClO
3,610

2-(Methoxycarbonyl)benzenesulfonamide, 98%

CAS: 57683-71-3 Molecular Formula: C8H9NO4S Molecular Weight (g/mol): 215.22 MDL Number: MFCD00009808 InChI Key: VSOOBQALJVLTBH-UHFFFAOYSA-N Synonym: methyl 2-aminosulfonyl benzoate,2-carbomethoxybenzenesulfonamide,2-sulfamoylbenzoic acid methyl ester,2-methoxycarbonyl benzene sulfonamide,methyl o-sulphamoylbenzoate,benzoic acid, 2-aminosulfonyl-, methyl ester,benzoic acid, 2-sulfamoyl-, methyl ester,2-methoxycarbonylphenylsulfonamide,2-methoxycarbonylbenzenesulfonamide,2-methoxycarbonyl benzenesulphonamide PubChem CID: 42546 ChEBI: CHEBI:83512 IUPAC Name: methyl 2-sulfamoylbenzoate SMILES: COC(=O)C1=CC=CC=C1S(N)(=O)=O

PubChem CID 42546
CAS 57683-71-3
Molecular Weight (g/mol) 215.22
ChEBI CHEBI:83512
MDL Number MFCD00009808
SMILES COC(=O)C1=CC=CC=C1S(N)(=O)=O
Synonym methyl 2-aminosulfonyl benzoate,2-carbomethoxybenzenesulfonamide,2-sulfamoylbenzoic acid methyl ester,2-methoxycarbonyl benzene sulfonamide,methyl o-sulphamoylbenzoate,benzoic acid, 2-aminosulfonyl-, methyl ester,benzoic acid, 2-sulfamoyl-, methyl ester,2-methoxycarbonylphenylsulfonamide,2-methoxycarbonylbenzenesulfonamide,2-methoxycarbonyl benzenesulphonamide
IUPAC Name methyl 2-sulfamoylbenzoate
InChI Key VSOOBQALJVLTBH-UHFFFAOYSA-N
Molecular Formula C8H9NO4S
3,611

1,1-Diphenylhydrazine hydrochloride, 98%

CAS: 530-47-2 Molecular Formula: C12H13ClN2 Molecular Weight (g/mol): 220.7 MDL Number: MFCD00012950 InChI Key: MIVUDWFNUOXEJM-UHFFFAOYSA-N Synonym: 1,1-diphenylhydrazine hydrochloride,n,n-diphenylhydrazine hydrochloride,unii-o8100cbz4n,diphenyl hydrazine hydrochloride,hydrazine, 1,1-diphenyl-, monohydrochloride,n,n-diphenylhydrazinium 1+ chloride,1,1-diphenylhydrazine hcl,1,1-diphenylhydrazine monohydrochloride,aminodiphenylamine, chloride,hydrazine, 1,1-diphenyl-, hydrochloride 1:1 PubChem CID: 10738 IUPAC Name: 1,1-diphenylhydrazine;hydrochloride SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)N.Cl

PubChem CID 10738
CAS 530-47-2
Molecular Weight (g/mol) 220.7
MDL Number MFCD00012950
SMILES C1=CC=C(C=C1)N(C2=CC=CC=C2)N.Cl
Synonym 1,1-diphenylhydrazine hydrochloride,n,n-diphenylhydrazine hydrochloride,unii-o8100cbz4n,diphenyl hydrazine hydrochloride,hydrazine, 1,1-diphenyl-, monohydrochloride,n,n-diphenylhydrazinium 1+ chloride,1,1-diphenylhydrazine hcl,1,1-diphenylhydrazine monohydrochloride,aminodiphenylamine, chloride,hydrazine, 1,1-diphenyl-, hydrochloride 1:1
IUPAC Name 1,1-diphenylhydrazine;hydrochloride
InChI Key MIVUDWFNUOXEJM-UHFFFAOYSA-N
Molecular Formula C12H13ClN2
3,612

Methyl 4-bromobenzoate, 98+%

CAS: 619-42-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00013531 InChI Key: CZNGTXVOZOWWKM-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate PubChem CID: 12081 IUPAC Name: methyl 4-bromobenzoate SMILES: COC(=O)C1=CC=C(C=C1)Br

PubChem CID 12081
CAS 619-42-1
Molecular Weight (g/mol) 215.046
MDL Number MFCD00013531
SMILES COC(=O)C1=CC=C(C=C1)Br
Synonym benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate
IUPAC Name methyl 4-bromobenzoate
InChI Key CZNGTXVOZOWWKM-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
3,613

3-(Trifluoromethyl)benzaldehyde, 97%

CAS: 454-89-7 Molecular Formula: C8H5F3O Molecular Weight (g/mol): 174.122 MDL Number: MFCD00003373 InChI Key: NMTUHPSKJJYGML-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzaldehyde,m-trifluoromethylbenzaldehyde,benzaldehyde, 3-trifluoromethyl,alpha,alpha,alpha-trifluoro-m-tolualdehyde,alpha,alpha,alpha-trifluoro-3-tolualdehyde,unii-at7h4h5u3e,a,a,a-trifluoro-m-tolualdehyde,3-trifluoromethyl-benzaldehyde,mtf-bad,3-formylbenzotrifluoride PubChem CID: 67990 IUPAC Name: 3-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=CC(=C1)C(F)(F)F)C=O

PubChem CID 67990
CAS 454-89-7
Molecular Weight (g/mol) 174.122
MDL Number MFCD00003373
SMILES C1=CC(=CC(=C1)C(F)(F)F)C=O
Synonym 3-trifluoromethyl benzaldehyde,m-trifluoromethylbenzaldehyde,benzaldehyde, 3-trifluoromethyl,alpha,alpha,alpha-trifluoro-m-tolualdehyde,alpha,alpha,alpha-trifluoro-3-tolualdehyde,unii-at7h4h5u3e,a,a,a-trifluoro-m-tolualdehyde,3-trifluoromethyl-benzaldehyde,mtf-bad,3-formylbenzotrifluoride
IUPAC Name 3-(trifluoromethyl)benzaldehyde
InChI Key NMTUHPSKJJYGML-UHFFFAOYSA-N
Molecular Formula C8H5F3O
3,614

2,6-Dichlorobenzoic acid, 97%

CAS: 50-30-6 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.01 MDL Number: MFCD00002418 InChI Key: MRUDNSFOFOQZDA-UHFFFAOYSA-N Synonym: benzoic acid, 2,6-dichloro,2,6-dichloro-benzoic acid,unii-634ri764qt,2,6 dichlorobenzoic acid,2,6-dichlorobenzoicacid,2,6-dichloro-benzoicacid,ccris 8610,pubchem20028,acmc-1auop,2.6-dichlorobenzoic acid PubChem CID: 5758 ChEBI: CHEBI:48623 IUPAC Name: 2,6-dichlorobenzoic acid SMILES: OC(=O)C1=C(Cl)C=CC=C1Cl

PubChem CID 5758
CAS 50-30-6
Molecular Weight (g/mol) 191.01
ChEBI CHEBI:48623
MDL Number MFCD00002418
SMILES OC(=O)C1=C(Cl)C=CC=C1Cl
Synonym benzoic acid, 2,6-dichloro,2,6-dichloro-benzoic acid,unii-634ri764qt,2,6 dichlorobenzoic acid,2,6-dichlorobenzoicacid,2,6-dichloro-benzoicacid,ccris 8610,pubchem20028,acmc-1auop,2.6-dichlorobenzoic acid
IUPAC Name 2,6-dichlorobenzoic acid
InChI Key MRUDNSFOFOQZDA-UHFFFAOYSA-N
Molecular Formula C7H4Cl2O2
3,615

Triphenylmethanol, 98%

CAS: 76-84-6 Molecular Formula: C19H16O Molecular Weight (g/mol): 260.34 MDL Number: MFCD00004445,MFCD10565638 InChI Key: LZTRCELOJRDYMQ-UHFFFAOYSA-N Synonym: triphenylcarbinol,trityl alcohol,tritanol,triphenylmethyl alcohol,triphenyl methanol,triphenyl carbinol,methanol, triphenyl,unii-u97q0ou9kb,triphenyl-methanol,benzenemethanol, .alpha.,.alpha.-diphenyl PubChem CID: 6457 IUPAC Name: triphenylmethanol SMILES: OC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 6457
CAS 76-84-6
Molecular Weight (g/mol) 260.34
MDL Number MFCD00004445,MFCD10565638
SMILES OC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym triphenylcarbinol,trityl alcohol,tritanol,triphenylmethyl alcohol,triphenyl methanol,triphenyl carbinol,methanol, triphenyl,unii-u97q0ou9kb,triphenyl-methanol,benzenemethanol, .alpha.,.alpha.-diphenyl
IUPAC Name triphenylmethanol
InChI Key LZTRCELOJRDYMQ-UHFFFAOYSA-N
Molecular Formula C19H16O