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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 (129,840)
Phenols (24,890)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,282)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
Pyrenes (285)
Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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1,006 – 1,020 of 158,365 results
1,006
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(R)-(+)-1,1'-Bi(2-naphthol), 99%

CAS: 18531-94-7 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O

PubChem CID 11762
CAS 18531-94-7
Molecular Weight (g/mol) 286.33
MDL Number MFCD00004068
SMILES C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
Synonym 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol
IUPAC Name 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
InChI Key PPTXVXKCQZKFBN-UHFFFAOYSA-N
Molecular Formula C20H14O2
1,007

Phenylacetaldehyde, 99.5%, For GC analysis, MP Biomedicals™

CAS: 122-78-1 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 MDL Number: MFCD00006993 InChI Key: DTUQWGWMVIHBKE-UHFFFAOYSA-N IUPAC Name: 2-phenylacetaldehyde SMILES: O=CCC1=CC=CC=C1

CAS 122-78-1
Molecular Weight (g/mol) 120.15
MDL Number MFCD00006993
SMILES O=CCC1=CC=CC=C1
IUPAC Name 2-phenylacetaldehyde
InChI Key DTUQWGWMVIHBKE-UHFFFAOYSA-N
Molecular Formula C8H8O
1,008

Dithranol, 99%, MP Biomedicals™

CAS: 1143-38-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00053409 InChI Key: NUZWLKWWNNJHPT-UHFFFAOYSA-N IUPAC Name: 1,8-dihydroxy-9,10-dihydroanthracen-9-one SMILES: OC1=CC=CC2=C1C(=O)C1=C(O)C=CC=C1C2

CAS 1143-38-0
Molecular Weight (g/mol) 226.23
MDL Number MFCD00053409
SMILES OC1=CC=CC2=C1C(=O)C1=C(O)C=CC=C1C2
IUPAC Name 1,8-dihydroxy-9,10-dihydroanthracen-9-one
InChI Key NUZWLKWWNNJHPT-UHFFFAOYSA-N
Molecular Formula C14H10O3
1,009
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8-Methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid, 98%

CAS: 32178-63-5 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD01075657 InChI Key: VOAFGTBETRJDPU-UHFFFAOYSA-N Synonym: 8-methoxy-1,2,3,4-tetrahydronaphtalene-2-carboxylic acid,1,2,3,4-tetrahydro-8-methoxynaphthalene-2-carboxylic acid,8-methoxy-1,2,3,4-tetrahydro-naphthalene-2-carboxylic acid,8-methoxy-1,2,3,4-tetrahydrophtalene-2-carboxylic acid,2-naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-8-methoxy PubChem CID: 3624709 IUPAC Name: 8-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid SMILES: COC1=CC=CC2=C1CC(CC2)C(=O)O

PubChem CID 3624709
CAS 32178-63-5
Molecular Weight (g/mol) 206.241
MDL Number MFCD01075657
SMILES COC1=CC=CC2=C1CC(CC2)C(=O)O
Synonym 8-methoxy-1,2,3,4-tetrahydronaphtalene-2-carboxylic acid,1,2,3,4-tetrahydro-8-methoxynaphthalene-2-carboxylic acid,8-methoxy-1,2,3,4-tetrahydro-naphthalene-2-carboxylic acid,8-methoxy-1,2,3,4-tetrahydrophtalene-2-carboxylic acid,2-naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-8-methoxy
IUPAC Name 8-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
InChI Key VOAFGTBETRJDPU-UHFFFAOYSA-N
Molecular Formula C12H14O3
1,010
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4-(Trifluoromethylthio)aniline, 98%

CAS: 372-16-7 Molecular Formula: C7H6F3NS Molecular Weight (g/mol): 193.19 MDL Number: MFCD00040926 InChI Key: OHHHTUXVBNGOGI-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio aniline,4-trifluoromethyl thio aniline,4-trifluoromethyl sulfanyl aniline,4-aminophenyl trifluoromethyl sulfide,4-aminophenyl trifluoromethyl sulphide,4-trifluoromethylsulfanyl aniline,benzenamine, 4-trifluoromethyl thio,4-trifluoromethylthio phenylamine PubChem CID: 123054 SMILES: NC1=CC=C(SC(F)(F)F)C=C1

PubChem CID 123054
CAS 372-16-7
Molecular Weight (g/mol) 193.19
MDL Number MFCD00040926
SMILES NC1=CC=C(SC(F)(F)F)C=C1
Synonym 4-trifluoromethylthio aniline,4-trifluoromethyl thio aniline,4-trifluoromethyl sulfanyl aniline,4-aminophenyl trifluoromethyl sulfide,4-aminophenyl trifluoromethyl sulphide,4-trifluoromethylsulfanyl aniline,benzenamine, 4-trifluoromethyl thio,4-trifluoromethylthio phenylamine
InChI Key OHHHTUXVBNGOGI-UHFFFAOYSA-N
Molecular Formula C7H6F3NS
1,011
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(R)-(+)-1-(3-Methoxyphenyl)ethylamine, ChiPros 99+%, ee 98%

CAS: 88196-70-7 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.209 MDL Number: MFCD00671655 InChI Key: CJWGCBRQAHCVHW-SSDOTTSWSA-N Synonym: r-1-3-methoxyphenyl ethanamine,r-1-3-methoxyphenyl ethylamine,1-r-3-methoxyphenol ethylamine,1r-1-3-methoxyphenyl ethanamine,1r-1-3-methoxyphenyl ethan-1-amine,r-+-1-3-methoxyphenyl ethylamine,phenol,3-1r-1-aminoethyl,1r-1-3-methoxyphenyl ethylamine,r-3-methoxy-alpha-methylbenzylamine,r-1 3-methoxyphenyl ethylamine PubChem CID: 7020759 IUPAC Name: (1R)-1-(3-methoxyphenyl)ethanamine SMILES: CC(C1=CC(=CC=C1)OC)N

PubChem CID 7020759
CAS 88196-70-7
Molecular Weight (g/mol) 151.209
MDL Number MFCD00671655
SMILES CC(C1=CC(=CC=C1)OC)N
Synonym r-1-3-methoxyphenyl ethanamine,r-1-3-methoxyphenyl ethylamine,1-r-3-methoxyphenol ethylamine,1r-1-3-methoxyphenyl ethanamine,1r-1-3-methoxyphenyl ethan-1-amine,r-+-1-3-methoxyphenyl ethylamine,phenol,3-1r-1-aminoethyl,1r-1-3-methoxyphenyl ethylamine,r-3-methoxy-alpha-methylbenzylamine,r-1 3-methoxyphenyl ethylamine
IUPAC Name (1R)-1-(3-methoxyphenyl)ethanamine
InChI Key CJWGCBRQAHCVHW-SSDOTTSWSA-N
Molecular Formula C9H13NO
1,012
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3-(Bromomethyl)phenoxyacetic acid, 97%

CAS: 136645-25-5 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.072 MDL Number: MFCD02093985 InChI Key: MSTODKGDFXWAIO-UHFFFAOYSA-N Synonym: 3-bromomethyl phenoxyacetic acid,2-3-bromomethyl phenoxy acetic acid,acmc-1c8fy PubChem CID: 7010327 IUPAC Name: 2-[3-(bromomethyl)phenoxy]acetic acid SMILES: C1=CC(=CC(=C1)OCC(=O)O)CBr

PubChem CID 7010327
CAS 136645-25-5
Molecular Weight (g/mol) 245.072
MDL Number MFCD02093985
SMILES C1=CC(=CC(=C1)OCC(=O)O)CBr
Synonym 3-bromomethyl phenoxyacetic acid,2-3-bromomethyl phenoxy acetic acid,acmc-1c8fy
IUPAC Name 2-[3-(bromomethyl)phenoxy]acetic acid
InChI Key MSTODKGDFXWAIO-UHFFFAOYSA-N
Molecular Formula C9H9BrO3
1,013
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3-(1-Piperazinyl)phenol, 97%

CAS: 59817-32-2 Molecular Formula: C10H14N2O Molecular Weight (g/mol): 178.24 MDL Number: MFCD00052896 InChI Key: AYGYICRITMSJOC-UHFFFAOYSA-N Synonym: 3-piperazin-1-yl phenol,1-3-hydroxyphenyl piperazine,3-1-piperazinyl phenol,n-3-hydroxyphenyl piperazine,3-piperazin-1-yl-phenol,1-3-hydroxyphenyl-piperazine,phenol, 3-1-piperazinyl,3-piperazinylphenol,3-hydroxyphenylpiperazine PubChem CID: 2736597 SMILES: OC1=CC=CC(=C1)N1CCNCC1

PubChem CID 2736597
CAS 59817-32-2
Molecular Weight (g/mol) 178.24
MDL Number MFCD00052896
SMILES OC1=CC=CC(=C1)N1CCNCC1
Synonym 3-piperazin-1-yl phenol,1-3-hydroxyphenyl piperazine,3-1-piperazinyl phenol,n-3-hydroxyphenyl piperazine,3-piperazin-1-yl-phenol,1-3-hydroxyphenyl-piperazine,phenol, 3-1-piperazinyl,3-piperazinylphenol,3-hydroxyphenylpiperazine
InChI Key AYGYICRITMSJOC-UHFFFAOYSA-N
Molecular Formula C10H14N2O
1,014
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3-Amino-2-naphthoic acid, 97%

CAS: 5959-52-4 Molecular Formula: C11H9NO2 MDL Number: MFCD00004115 InChI Key: XFXOLBNQYFRSLQ-UHFFFAOYSA-N Synonym: 3-amino-2-naphthoic acid,2-amino-3-naphthoic acid,3-aminoisonaphthoic acid,2-naphthalenecarboxylic acid, 3-amino,2-amino-3-carboxynaphthalene,2-naphthoic acid, 3-amino,3-amino-2-naphthalenecarboxylic acid,unii-iv5z0phl5d,iv5z0phl5d,3-amino-naphthalene-2-carboxylic acid PubChem CID: 22244 IUPAC Name: 3-aminonaphthalene-2-carboxylic acid

PubChem CID 22244
CAS 5959-52-4
MDL Number MFCD00004115
Synonym 3-amino-2-naphthoic acid,2-amino-3-naphthoic acid,3-aminoisonaphthoic acid,2-naphthalenecarboxylic acid, 3-amino,2-amino-3-carboxynaphthalene,2-naphthoic acid, 3-amino,3-amino-2-naphthalenecarboxylic acid,unii-iv5z0phl5d,iv5z0phl5d,3-amino-naphthalene-2-carboxylic acid
IUPAC Name 3-aminonaphthalene-2-carboxylic acid
InChI Key XFXOLBNQYFRSLQ-UHFFFAOYSA-N
Molecular Formula C11H9NO2
1,015
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2-Hydroxybenzeneboronic acid, 97%

CAS: 89466-08-0 Molecular Formula: C6H7BO3 Molecular Weight (g/mol): 137.93 MDL Number: MFCD01074581 InChI Key: YDMRDHQUQIVWBE-UHFFFAOYSA-N Synonym: 2-hydroxyphenyl boronic acid,2-hydroxybenzeneboronic acid,o-hydroxyphenylboronic acid,2-boronophenol,2-hydroxyphenyl boranediol,2-hydroxyphenylboronicacid,boronic acid, 2-hydroxyphenyl,pubchem9522,2-hydroxyphenylboronic,acmc-209r1d PubChem CID: 2773454 IUPAC Name: (2-hydroxyphenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1O

PubChem CID 2773454
CAS 89466-08-0
Molecular Weight (g/mol) 137.93
MDL Number MFCD01074581
SMILES OB(O)C1=CC=CC=C1O
Synonym 2-hydroxyphenyl boronic acid,2-hydroxybenzeneboronic acid,o-hydroxyphenylboronic acid,2-boronophenol,2-hydroxyphenyl boranediol,2-hydroxyphenylboronicacid,boronic acid, 2-hydroxyphenyl,pubchem9522,2-hydroxyphenylboronic,acmc-209r1d
IUPAC Name (2-hydroxyphenyl)boronic acid
InChI Key YDMRDHQUQIVWBE-UHFFFAOYSA-N
Molecular Formula C6H7BO3
1,016
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1,3-Benzenedithiol, 97%

CAS: 626-04-0 Molecular Formula: C6H6S2 Molecular Weight (g/mol): 142.23 MDL Number: MFCD00004842 InChI Key: ZWOASCVFHSYHOB-UHFFFAOYSA-N Synonym: 1,3-benzenedithiol,1,3-dimercaptobenzene,dithioresorcin,dithioresorcinol,1,3-benzedithiol,acmc-20ap5g,ksc357g0j PubChem CID: 522062 IUPAC Name: benzene-1,3-dithiol SMILES: SC1=CC(S)=CC=C1

PubChem CID 522062
CAS 626-04-0
Molecular Weight (g/mol) 142.23
MDL Number MFCD00004842
SMILES SC1=CC(S)=CC=C1
Synonym 1,3-benzenedithiol,1,3-dimercaptobenzene,dithioresorcin,dithioresorcinol,1,3-benzedithiol,acmc-20ap5g,ksc357g0j
IUPAC Name benzene-1,3-dithiol
InChI Key ZWOASCVFHSYHOB-UHFFFAOYSA-N
Molecular Formula C6H6S2
1,017
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1,4-Benzenedithiol, 97%

CAS: 624-39-5 Molecular Formula: C6H6S2 Molecular Weight (g/mol): 142.23 MDL Number: MFCD00142541 InChI Key: WYLQRHZSKIDFEP-UHFFFAOYSA-N Synonym: 1,4-benzenedithiol,dithiohydroquinone,1,4-dimercaptobenzene,4-mercaptothiophenol,1,4-benzene dithiol,pubchem6866,acmc-1b45q,benzene-1,4-dithiol gc PubChem CID: 4691729 IUPAC Name: benzene-1,4-dithiol SMILES: SC1=CC=C(S)C=C1

PubChem CID 4691729
CAS 624-39-5
Molecular Weight (g/mol) 142.23
MDL Number MFCD00142541
SMILES SC1=CC=C(S)C=C1
Synonym 1,4-benzenedithiol,dithiohydroquinone,1,4-dimercaptobenzene,4-mercaptothiophenol,1,4-benzene dithiol,pubchem6866,acmc-1b45q,benzene-1,4-dithiol gc
IUPAC Name benzene-1,4-dithiol
InChI Key WYLQRHZSKIDFEP-UHFFFAOYSA-N
Molecular Formula C6H6S2
1,018
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2-Methyl-1-phenyl-2-propen-1-ol, tech. 85%

CAS: 4383-08-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00046630 InChI Key: ZGYBYYJGIKPBFD-UHFFFAOYNA-N Synonym: 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine PubChem CID: 138211 IUPAC Name: 2-methyl-1-phenylprop-2-en-1-ol SMILES: CC(=C)C(C1=CC=CC=C1)O

PubChem CID 138211
CAS 4383-08-8
Molecular Weight (g/mol) 148.21
MDL Number MFCD00046630
SMILES CC(=C)C(C1=CC=CC=C1)O
Synonym 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine
IUPAC Name 2-methyl-1-phenylprop-2-en-1-ol
InChI Key ZGYBYYJGIKPBFD-UHFFFAOYNA-N
Molecular Formula C10H12O
1,019
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4-Nitrophenylacetone, 98%

CAS: 5332-96-7 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00051518 InChI Key: GEWWCWZGHNIUBW-UHFFFAOYSA-N Synonym: 4-nitrophenylacetone,1-4-nitrophenyl propan-2-one,2-propanone, 1-4-nitrophenyl,1-4-nitrophenyl-2-propanone,1-4-nitrophenyl acetone,p-nitrophenylazeton,p-nitrophenylacetone,pubchem18646,4-nitrophenyl acetone,acmc-1az6k PubChem CID: 219367 IUPAC Name: 1-(4-nitrophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 219367
CAS 5332-96-7
Molecular Weight (g/mol) 179.175
MDL Number MFCD00051518
SMILES CC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]
Synonym 4-nitrophenylacetone,1-4-nitrophenyl propan-2-one,2-propanone, 1-4-nitrophenyl,1-4-nitrophenyl-2-propanone,1-4-nitrophenyl acetone,p-nitrophenylazeton,p-nitrophenylacetone,pubchem18646,4-nitrophenyl acetone,acmc-1az6k
IUPAC Name 1-(4-nitrophenyl)propan-2-one
InChI Key GEWWCWZGHNIUBW-UHFFFAOYSA-N
Molecular Formula C9H9NO3
1,020
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3-n-Propylphenol, 98%

CAS: 621-27-2 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD01632130 InChI Key: MPWGZBWDLMDIHO-UHFFFAOYSA-N Synonym: 3-n-propylphenol,m-propylphenol,phenol, 3-propyl,phenol, m-propyl,unii-593r721cic,1-hydroxy-3-n-propylbenzene,phenol, m-propyl-8ci,phenol, 3-propyl-9ci PubChem CID: 69302 IUPAC Name: 3-propylphenol SMILES: CCCC1=CC(=CC=C1)O

PubChem CID 69302
CAS 621-27-2
Molecular Weight (g/mol) 136.194
MDL Number MFCD01632130
SMILES CCCC1=CC(=CC=C1)O
Synonym 3-n-propylphenol,m-propylphenol,phenol, 3-propyl,phenol, m-propyl,unii-593r721cic,1-hydroxy-3-n-propylbenzene,phenol, m-propyl-8ci,phenol, 3-propyl-9ci
IUPAC Name 3-propylphenol
InChI Key MPWGZBWDLMDIHO-UHFFFAOYSA-N
Molecular Formula C9H12O