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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 (67,620)
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Naphthalenes (5,064)
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Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (559)
Anthracenes (413)
Phenanthrenes and derivatives (327)
Tetralins (327)
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Ellagic acids and derivatives (33)
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Acenaphthylenes (15)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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1,951 – 1,965 of 78,436 results
1,951

5-Chloro-2-fluorobenzoic acid, 97%, Thermo Scientific™

CAS: 394-30-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.56 InChI Key: WGAVMKXCDMQVNF-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzoic acid,5-chloro-2-fluoro-benzoic acid,5-chloro-2-fluorobenzoicacid,benzoic acid, 5-chloro-2-fluoro,pubchem1375,acmc-1aigz,ksc223m7h,rarechem al bo 0944,5-chloro-2-fluorobenzoic acid,benzoicacid, 5-chloro-2-fluoro PubChem CID: 2736537 IUPAC Name: 5-chloro-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)F

PubChem CID 2736537
CAS 394-30-9
Molecular Weight (g/mol) 174.56
SMILES C1=CC(=C(C=C1Cl)C(=O)O)F
Synonym 2-fluoro-5-chlorobenzoic acid,5-chloro-2-fluoro-benzoic acid,5-chloro-2-fluorobenzoicacid,benzoic acid, 5-chloro-2-fluoro,pubchem1375,acmc-1aigz,ksc223m7h,rarechem al bo 0944,5-chloro-2-fluorobenzoic acid,benzoicacid, 5-chloro-2-fluoro
IUPAC Name 5-chloro-2-fluorobenzoic acid
InChI Key WGAVMKXCDMQVNF-UHFFFAOYSA-N
Molecular Formula C7H4ClFO2
1,952

Aspirin, USP, 99.5-100.5%, Spectrum™ Chemical
SDP

CAS: 50-78-2 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002430 InChI Key: BSYNRYMUTXBXSQ-UHFFFAOYSA-N IUPAC Name: 2-(acetyloxy)benzoic acid SMILES: CC(=O)OC1=CC=CC=C1C(O)=O

CAS 50-78-2
Molecular Weight (g/mol) 180.16
MDL Number MFCD00002430
SMILES CC(=O)OC1=CC=CC=C1C(O)=O
IUPAC Name 2-(acetyloxy)benzoic acid
InChI Key BSYNRYMUTXBXSQ-UHFFFAOYSA-N
Molecular Formula C9H8O4
1,953

Ethyl 3-fluorobenzoate, 98+%

CAS: 451-02-5 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00000336 InChI Key: SMMIKBXLEWTSJD-UHFFFAOYSA-N Synonym: ethyl m-fluorobenzoate,benzoic acid, 3-fluoro-, ethyl ester,3-fluorobenzoic acid ethyl ester,3-fluoro-benzoic acid ethyl ester,benzoic acid, m-fluoro-, ethyl ester,pubchem3470,3-fluorobenzoic acid ethyl,acmc-209k0o,ethyl3-fluorobenzoate,3-fluoro-benzoicaciethylester PubChem CID: 67975 IUPAC Name: ethyl 3-fluorobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)F

PubChem CID 67975
CAS 451-02-5
Molecular Weight (g/mol) 168.167
MDL Number MFCD00000336
SMILES CCOC(=O)C1=CC(=CC=C1)F
Synonym ethyl m-fluorobenzoate,benzoic acid, 3-fluoro-, ethyl ester,3-fluorobenzoic acid ethyl ester,3-fluoro-benzoic acid ethyl ester,benzoic acid, m-fluoro-, ethyl ester,pubchem3470,3-fluorobenzoic acid ethyl,acmc-209k0o,ethyl3-fluorobenzoate,3-fluoro-benzoicaciethylester
IUPAC Name ethyl 3-fluorobenzoate
InChI Key SMMIKBXLEWTSJD-UHFFFAOYSA-N
Molecular Formula C9H9FO2
1,954

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

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
1,955

2,5-Dibromobenzoic acid, 98%

CAS: 610-71-9 Molecular Formula: C7H4Br2O2 Molecular Weight (g/mol): 279.92 MDL Number: MFCD00016494 InChI Key: SQQKOTVDGCJJKI-UHFFFAOYSA-N Synonym: benzoic acid, 2,5-dibromo,rarechem fh 1w 0049,pubchem3859,2,5-dibromobenzoicacid,2,5-dibromo-benzoic acid,benzoicacid, 2,5-dibromo,4-09-00-01027 beilstein handbook reference,ksc353s4r,acmc-1b114,2,5-dibromobenzoic acid PubChem CID: 11891 IUPAC Name: 2,5-dibromobenzoic acid SMILES: OC(=O)C1=CC(Br)=CC=C1Br

PubChem CID 11891
CAS 610-71-9
Molecular Weight (g/mol) 279.92
MDL Number MFCD00016494
SMILES OC(=O)C1=CC(Br)=CC=C1Br
Synonym benzoic acid, 2,5-dibromo,rarechem fh 1w 0049,pubchem3859,2,5-dibromobenzoicacid,2,5-dibromo-benzoic acid,benzoicacid, 2,5-dibromo,4-09-00-01027 beilstein handbook reference,ksc353s4r,acmc-1b114,2,5-dibromobenzoic acid
IUPAC Name 2,5-dibromobenzoic acid
InChI Key SQQKOTVDGCJJKI-UHFFFAOYSA-N
Molecular Formula C7H4Br2O2
1,956

Methyl 4-fluoro-2-methoxybenzoate, 97+%, Thermo Scientific Chemicals

CAS: 204707-42-6 Molecular Formula: C9H9FO3 Molecular Weight (g/mol): 184.17 MDL Number: MFCD06203990 InChI Key: LJUAEPNTXDJBRX-UHFFFAOYSA-N Synonym: 4-fluoro-2-methoxybenzoic acid methyl ester,methyl 2-methoxy-4-fluoro-benzoate,benzoic acid, 4-fluoro-2-methoxy-, methyl ester,rarechem al bf 1023,methyl-4-fluoro-2-methoxybenzoate,methyl 4-fluoranyl-2-methoxy-benzoate,2-methoxy-4-fluorobenzoic acid methyl ester,4-fluoro-2-methoxy-benzoic acid methyl ester PubChem CID: 10241478 IUPAC Name: methyl 4-fluoro-2-methoxybenzoate SMILES: COC(=O)C1=C(OC)C=C(F)C=C1

PubChem CID 10241478
CAS 204707-42-6
Molecular Weight (g/mol) 184.17
MDL Number MFCD06203990
SMILES COC(=O)C1=C(OC)C=C(F)C=C1
Synonym 4-fluoro-2-methoxybenzoic acid methyl ester,methyl 2-methoxy-4-fluoro-benzoate,benzoic acid, 4-fluoro-2-methoxy-, methyl ester,rarechem al bf 1023,methyl-4-fluoro-2-methoxybenzoate,methyl 4-fluoranyl-2-methoxy-benzoate,2-methoxy-4-fluorobenzoic acid methyl ester,4-fluoro-2-methoxy-benzoic acid methyl ester
IUPAC Name methyl 4-fluoro-2-methoxybenzoate
InChI Key LJUAEPNTXDJBRX-UHFFFAOYSA-N
Molecular Formula C9H9FO3
1,957

Ethyl 4-fluorobenzoate, 99%

CAS: 451-46-7 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00000351 InChI Key: UMPRJGKLMUDRHL-UHFFFAOYSA-N Synonym: 4-fluorobenzoic acid ethyl ester,ethyl p-fluorobenzoate,benzoic acid, 4-fluoro-, ethyl ester,p-fluorobenzoic acid, ethyl ester,ethyl4-fluorobenzoate,4-fluoro-benzoic acid ethyl ester,benzoic acid, p-fluoro-, ethyl ester,ethyep-fluorobenzoate,pubchem3471,ethyl-4-fluorobenzoate PubChem CID: 67976 IUPAC Name: ethyl 4-fluorobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)F

PubChem CID 67976
CAS 451-46-7
Molecular Weight (g/mol) 168.17
MDL Number MFCD00000351
SMILES CCOC(=O)C1=CC=C(C=C1)F
Synonym 4-fluorobenzoic acid ethyl ester,ethyl p-fluorobenzoate,benzoic acid, 4-fluoro-, ethyl ester,p-fluorobenzoic acid, ethyl ester,ethyl4-fluorobenzoate,4-fluoro-benzoic acid ethyl ester,benzoic acid, p-fluoro-, ethyl ester,ethyep-fluorobenzoate,pubchem3471,ethyl-4-fluorobenzoate
IUPAC Name ethyl 4-fluorobenzoate
InChI Key UMPRJGKLMUDRHL-UHFFFAOYSA-N
Molecular Formula C9H9FO2
1,958

2-Chloro-6-fluorobenzamide, 98%

CAS: 66073-54-9 Molecular Formula: C7H5ClFNO Molecular Weight (g/mol): 173.571 MDL Number: MFCD00055436 InChI Key: KLOZZZNFJYMTNE-UHFFFAOYSA-N PubChem CID: 98564 IUPAC Name: 2-chloro-6-fluorobenzamide SMILES: C1=CC(=C(C(=C1)Cl)C(=O)N)F

PubChem CID 98564
CAS 66073-54-9
Molecular Weight (g/mol) 173.571
MDL Number MFCD00055436
SMILES C1=CC(=C(C(=C1)Cl)C(=O)N)F
IUPAC Name 2-chloro-6-fluorobenzamide
InChI Key KLOZZZNFJYMTNE-UHFFFAOYSA-N
Molecular Formula C7H5ClFNO
1,959

Methyl 2-amino-5-chlorobenzoate, 98+%

CAS: 5202-89-1 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.607 MDL Number: MFCD00007837 InChI Key: IGHVUURTQGBABT-UHFFFAOYSA-N Synonym: methyl 5-chloroanthranilate,methyl2-amino-5-chlorobenzoate,5-chloroanthranilic acid methyl ester,benzoic acid, 2-amino-5-chloro-, methyl ester,2-amino-5-chlorobenzoic acid methyl ester,anthranilic acid, 5-chloro-, methyl ester,2-amino-5-chloro-benzoic acid methyl ester,pubchem3346,acmc-1axns,methyl-5-chloroanthranilate PubChem CID: 78878 IUPAC Name: methyl 2-amino-5-chlorobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)Cl)N

PubChem CID 78878
CAS 5202-89-1
Molecular Weight (g/mol) 185.607
MDL Number MFCD00007837
SMILES COC(=O)C1=C(C=CC(=C1)Cl)N
Synonym methyl 5-chloroanthranilate,methyl2-amino-5-chlorobenzoate,5-chloroanthranilic acid methyl ester,benzoic acid, 2-amino-5-chloro-, methyl ester,2-amino-5-chlorobenzoic acid methyl ester,anthranilic acid, 5-chloro-, methyl ester,2-amino-5-chloro-benzoic acid methyl ester,pubchem3346,acmc-1axns,methyl-5-chloroanthranilate
IUPAC Name methyl 2-amino-5-chlorobenzoate
InChI Key IGHVUURTQGBABT-UHFFFAOYSA-N
Molecular Formula C8H8ClNO2
1,960

4-Chloro-2,5-difluorobenzoic acid, 97%, Thermo Scientific™

CAS: 132794-07-1 Molecular Formula: C7H2ClF2O2 Molecular Weight (g/mol): 191.54 MDL Number: MFCD00077480 InChI Key: PEPCYJSDHYMIFN-UHFFFAOYSA-M Synonym: 2,5-difluoro-4-chlorobenzoic acid,4-chloro-2,5-difluorobenzoicacid,4-chloro-2,5-difluoro-benzoic acid,benzoic acid, 4-chloro-2,5-difluoro,pubchem1367,intermediates-zcf02018,acmc-1c2s0,2,5-difluoro-4-chlorobenzoicacid,attercop-chm at136451,2,5-difluoro-4-chloro-benzoic acid PubChem CID: 2733274 IUPAC Name: 4-chloro-2,5-difluorobenzoic acid SMILES: [O-]C(=O)C1=CC(F)=C(Cl)C=C1F

PubChem CID 2733274
CAS 132794-07-1
Molecular Weight (g/mol) 191.54
MDL Number MFCD00077480
SMILES [O-]C(=O)C1=CC(F)=C(Cl)C=C1F
Synonym 2,5-difluoro-4-chlorobenzoic acid,4-chloro-2,5-difluorobenzoicacid,4-chloro-2,5-difluoro-benzoic acid,benzoic acid, 4-chloro-2,5-difluoro,pubchem1367,intermediates-zcf02018,acmc-1c2s0,2,5-difluoro-4-chlorobenzoicacid,attercop-chm at136451,2,5-difluoro-4-chloro-benzoic acid
IUPAC Name 4-chloro-2,5-difluorobenzoic acid
InChI Key PEPCYJSDHYMIFN-UHFFFAOYSA-M
Molecular Formula C7H2ClF2O2
1,961

Methyl 2-amino-5-bromobenzoate, 98%

CAS: 52727-57-8 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.06 MDL Number: MFCD00144761 InChI Key: QVNYNHCNNGKULA-UHFFFAOYSA-N Synonym: methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7 PubChem CID: 736224 IUPAC Name: methyl 2-amino-5-bromobenzoate SMILES: COC(=O)C1=CC(Br)=CC=C1N

PubChem CID 736224
CAS 52727-57-8
Molecular Weight (g/mol) 230.06
MDL Number MFCD00144761
SMILES COC(=O)C1=CC(Br)=CC=C1N
Synonym methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7
IUPAC Name methyl 2-amino-5-bromobenzoate
InChI Key QVNYNHCNNGKULA-UHFFFAOYSA-N
Molecular Formula C8H8BrNO2
1,962

3-Bromobenzoic acid, 99%

CAS: 585-76-2 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD00002487 InChI Key: VOIZNVUXCQLQHS-UHFFFAOYSA-N Synonym: m-bromobenzoic acid,3-brombenzoic acid,benzoic acid, 3-bromo,3-bromo-benzoic acid,benzoic acid, m-bromo,unii-7dct3a73lx,7dct3a73lx,3-bromo benzene acid,3-bromobenzoicacid,4-fluorobenzoicacid PubChem CID: 11456 IUPAC Name: 3-bromobenzoic acid SMILES: C1=CC(=CC(=C1)Br)C(=O)O

PubChem CID 11456
CAS 585-76-2
Molecular Weight (g/mol) 201.02
MDL Number MFCD00002487
SMILES C1=CC(=CC(=C1)Br)C(=O)O
Synonym m-bromobenzoic acid,3-brombenzoic acid,benzoic acid, 3-bromo,3-bromo-benzoic acid,benzoic acid, m-bromo,unii-7dct3a73lx,7dct3a73lx,3-bromo benzene acid,3-bromobenzoicacid,4-fluorobenzoicacid
IUPAC Name 3-bromobenzoic acid
InChI Key VOIZNVUXCQLQHS-UHFFFAOYSA-N
Molecular Formula C7H5BrO2
1,963

L-Noradrenaline, 98%

CAS: 51-41-2 Molecular Formula: C8H11NO3 Molecular Weight (g/mol): 169.18 MDL Number: MFCD00025592 InChI Key: SFLSHLFXELFNJZ-QMMMGPOBSA-N Synonym: norepinephrine,l-noradrenaline,levarterenol,arterenol,noradrenaline,levophed,--norepinephrine,l-norepinephrine,r-noradrenaline,r-norepinephrine PubChem CID: 439260 ChEBI: CHEBI:18357 IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol SMILES: NC[C@H](O)C1=CC=C(O)C(O)=C1

PubChem CID 439260
CAS 51-41-2
Molecular Weight (g/mol) 169.18
ChEBI CHEBI:18357
MDL Number MFCD00025592
SMILES NC[C@H](O)C1=CC=C(O)C(O)=C1
Synonym norepinephrine,l-noradrenaline,levarterenol,arterenol,noradrenaline,levophed,--norepinephrine,l-norepinephrine,r-noradrenaline,r-norepinephrine
IUPAC Name 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol
InChI Key SFLSHLFXELFNJZ-QMMMGPOBSA-N
Molecular Formula C8H11NO3
1,964

3,5-Dihydroxytoluene monohydrate, 97%

CAS: 6153-39-5 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00149092 InChI Key: NBKPNAMTHBIMLA-UHFFFAOYSA-N Synonym: 5-methylbenzene-1,3-diol hydrate,orcinol monohydrate,5-methylresorcinol monohydrate,3,5-dihydroxytoluene monohydrate,orcinol hydrate,resorcinol, 5-methyl-, monohydrate,1,3-benzenediol, 5-methyl-, monohydrate,1,3-dihydroxy-5-methylbenzene monohydrate,acmc-209mtl,5-methylresorcinol hydrate PubChem CID: 3083941 IUPAC Name: 5-methylbenzene-1,3-diol;hydrate SMILES: CC1=CC(=CC(=C1)O)O.O

PubChem CID 3083941
CAS 6153-39-5
Molecular Weight (g/mol) 142.154
MDL Number MFCD00149092
SMILES CC1=CC(=CC(=C1)O)O.O
Synonym 5-methylbenzene-1,3-diol hydrate,orcinol monohydrate,5-methylresorcinol monohydrate,3,5-dihydroxytoluene monohydrate,orcinol hydrate,resorcinol, 5-methyl-, monohydrate,1,3-benzenediol, 5-methyl-, monohydrate,1,3-dihydroxy-5-methylbenzene monohydrate,acmc-209mtl,5-methylresorcinol hydrate
IUPAC Name 5-methylbenzene-1,3-diol;hydrate
InChI Key NBKPNAMTHBIMLA-UHFFFAOYSA-N
Molecular Formula C7H10O3
1,965

2-Allyl-4,6-dibenzoylresorcinol, 98%

CAS: 102593-74-8 Molecular Formula: C23H18O4 Molecular Weight (g/mol): 358.393 MDL Number: MFCD02094038 InChI Key: FSYGSBMXRNPJAD-UHFFFAOYSA-N Synonym: 2-allyl-4,6-dibenzoylresorcinol,5-allyl-4,6-dihydroxy-1,3-phenylene bis phenylmethanone,methanone, 4,6-dihydroxy-5-2-propenyl-1,3-phenylene bis phenyl,4,6-dibenzoyl-2-prop-2-en-1-yl benzene-1,3-diol,2allyl-4,6-dibenzoylresorcinol,methanone, 1,1'-4,6-dihydroxy-5-2-propen-1-yl-1,3-phenylene bis 1-phenyl,pubchem21315,acmc-20ao5t PubChem CID: 7010346 IUPAC Name: (5-benzoyl-2,4-dihydroxy-3-prop-2-enylphenyl)-phenylmethanone SMILES: C=CCC1=C(C(=CC(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O

PubChem CID 7010346
CAS 102593-74-8
Molecular Weight (g/mol) 358.393
MDL Number MFCD02094038
SMILES C=CCC1=C(C(=CC(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O
Synonym 2-allyl-4,6-dibenzoylresorcinol,5-allyl-4,6-dihydroxy-1,3-phenylene bis phenylmethanone,methanone, 4,6-dihydroxy-5-2-propenyl-1,3-phenylene bis phenyl,4,6-dibenzoyl-2-prop-2-en-1-yl benzene-1,3-diol,2allyl-4,6-dibenzoylresorcinol,methanone, 1,1'-4,6-dihydroxy-5-2-propen-1-yl-1,3-phenylene bis 1-phenyl,pubchem21315,acmc-20ao5t
IUPAC Name (5-benzoyl-2,4-dihydroxy-3-prop-2-enylphenyl)-phenylmethanone
InChI Key FSYGSBMXRNPJAD-UHFFFAOYSA-N
Molecular Formula C23H18O4