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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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991 – 1,005 of 158,365 results
991
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2-Nitrophenylacetonitrile, 98%

CAS: 610-66-2 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD00007183 InChI Key: YPRFCQAWSNWRLM-UHFFFAOYSA-N Synonym: 2-nitrophenylacetonitrile,2-2-nitrophenyl acetonitrile,2-nitrophenyl acetonitrile,benzeneacetonitrile, 2-nitro,2-nitrobenzyl cyanide,o-nitrophenyl acetonitrile,o-nitrobenzacetonitrile,2-nitrobenzeneacetonitrile,2-nitrobenzyl nitrile,acetonitrile, o-nitrophenyl PubChem CID: 11888 IUPAC Name: 2-(2-nitrophenyl)acetonitrile SMILES: [O-][N+](=O)C1=CC=CC=C1CC#N

PubChem CID 11888
CAS 610-66-2
Molecular Weight (g/mol) 162.15
MDL Number MFCD00007183
SMILES [O-][N+](=O)C1=CC=CC=C1CC#N
Synonym 2-nitrophenylacetonitrile,2-2-nitrophenyl acetonitrile,2-nitrophenyl acetonitrile,benzeneacetonitrile, 2-nitro,2-nitrobenzyl cyanide,o-nitrophenyl acetonitrile,o-nitrobenzacetonitrile,2-nitrobenzeneacetonitrile,2-nitrobenzyl nitrile,acetonitrile, o-nitrophenyl
IUPAC Name 2-(2-nitrophenyl)acetonitrile
InChI Key YPRFCQAWSNWRLM-UHFFFAOYSA-N
Molecular Formula C8H6N2O2
992
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3,5-Bis(trifluoromethyl)phenyl isothiocyanate, 98%

CAS: 23165-29-9 Molecular Formula: C9H3F6NS Molecular Weight (g/mol): 271.18 MDL Number: MFCD00040838 InChI Key: FXOSSGVJGGNASE-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl phenylisothiocyanate,isothiocyanic acid 3,5-bis trifluoromethyl phenyl ester,3,5-di trifluoromethyl phenyl isothiocyanate,3,5-bis-trifluoromethyl phenyl isothiocyanate,3,5-bis-trifluoromethylphenyl isothiocyanate,benzene, 1-isothiocyanato-3,5-bis trifluoromethyl,pubchem5019,acmc-209g1w PubChem CID: 2733395 IUPAC Name: 1-isothiocyanato-3,5-bis(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC(=CC(=C1)N=C=S)C(F)(F)F

PubChem CID 2733395
CAS 23165-29-9
Molecular Weight (g/mol) 271.18
MDL Number MFCD00040838
SMILES FC(F)(F)C1=CC(=CC(=C1)N=C=S)C(F)(F)F
Synonym 3,5-bis trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl phenylisothiocyanate,isothiocyanic acid 3,5-bis trifluoromethyl phenyl ester,3,5-di trifluoromethyl phenyl isothiocyanate,3,5-bis-trifluoromethyl phenyl isothiocyanate,3,5-bis-trifluoromethylphenyl isothiocyanate,benzene, 1-isothiocyanato-3,5-bis trifluoromethyl,pubchem5019,acmc-209g1w
IUPAC Name 1-isothiocyanato-3,5-bis(trifluoromethyl)benzene
InChI Key FXOSSGVJGGNASE-UHFFFAOYSA-N
Molecular Formula C9H3F6NS
993
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2-Fluoro-3-methylbenzyl bromide, 97%

CAS: 151412-12-3 Molecular Formula: C8H8BrF Molecular Weight (g/mol): 203.054 MDL Number: MFCD00042470 InChI Key: DCGWFNZSJBIAKE-UHFFFAOYSA-N Synonym: 2-fluoro-3-methylbenzyl bromide,1-bromomethyl-2-fluoro-3-methylbenzene,benzene,1-bromomethyl-2-fluoro-3-methyl,acmc-20anvi,2-fluoro-3-methylbenzylbromide,2-fluoro-3-methyl-benzylbromide,2-fluoro-3-methyl benzyl bromide,3-bromomethyl-2-fluoro-1-methylbenzene,1-bromomethyl-2-fluoro-3-methylbenzene # PubChem CID: 519062 IUPAC Name: 1-(bromomethyl)-2-fluoro-3-methylbenzene SMILES: CC1=C(C(=CC=C1)CBr)F

PubChem CID 519062
CAS 151412-12-3
Molecular Weight (g/mol) 203.054
MDL Number MFCD00042470
SMILES CC1=C(C(=CC=C1)CBr)F
Synonym 2-fluoro-3-methylbenzyl bromide,1-bromomethyl-2-fluoro-3-methylbenzene,benzene,1-bromomethyl-2-fluoro-3-methyl,acmc-20anvi,2-fluoro-3-methylbenzylbromide,2-fluoro-3-methyl-benzylbromide,2-fluoro-3-methyl benzyl bromide,3-bromomethyl-2-fluoro-1-methylbenzene,1-bromomethyl-2-fluoro-3-methylbenzene #
IUPAC Name 1-(bromomethyl)-2-fluoro-3-methylbenzene
InChI Key DCGWFNZSJBIAKE-UHFFFAOYSA-N
Molecular Formula C8H8BrF
994
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2-Methyl-1-phenyl-1-propanol, 98%

CAS: 611-69-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00065000 InChI Key: GMDYDZMQHRTHJA-UHFFFAOYSA-N Synonym: 2-methyl-1-phenyl-1-propanol,.alpha.-isopropylbenzyl alcohol,isopropyl benzyl alcohol,2-methyl-1-phenylpropanol,benzenemethanol, .alpha.-1-methylethyl,1-phenyl-2-methylpropyl alcohol,1r-2-methyl-1-phenyl-propan-1-ol,phenylisopropylcarbinol,isopropylphenylcarbinol,acmc-20anr9 PubChem CID: 95626 IUPAC Name: 2-methyl-1-phenylpropan-1-ol SMILES: CC(C)C(C1=CC=CC=C1)O

PubChem CID 95626
CAS 611-69-8
Molecular Weight (g/mol) 150.221
MDL Number MFCD00065000
SMILES CC(C)C(C1=CC=CC=C1)O
Synonym 2-methyl-1-phenyl-1-propanol,.alpha.-isopropylbenzyl alcohol,isopropyl benzyl alcohol,2-methyl-1-phenylpropanol,benzenemethanol, .alpha.-1-methylethyl,1-phenyl-2-methylpropyl alcohol,1r-2-methyl-1-phenyl-propan-1-ol,phenylisopropylcarbinol,isopropylphenylcarbinol,acmc-20anr9
IUPAC Name 2-methyl-1-phenylpropan-1-ol
InChI Key GMDYDZMQHRTHJA-UHFFFAOYSA-N
Molecular Formula C10H14O
995
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Dimethyl 5-aminoisophthalate, 98%

CAS: 99-27-4 Molecular Formula: C10H11NO4 Molecular Weight (g/mol): 209.201 MDL Number: MFCD00008435 InChI Key: DEKPYXUDJRABNK-UHFFFAOYSA-N PubChem CID: 66831 IUPAC Name: dimethyl 5-aminobenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(=C1)N)C(=O)OC

PubChem CID 66831
CAS 99-27-4
Molecular Weight (g/mol) 209.201
MDL Number MFCD00008435
SMILES COC(=O)C1=CC(=CC(=C1)N)C(=O)OC
IUPAC Name dimethyl 5-aminobenzene-1,3-dicarboxylate
InChI Key DEKPYXUDJRABNK-UHFFFAOYSA-N
Molecular Formula C10H11NO4
996
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4-n-Propoxyphenol, 98%

CAS: 18979-50-5 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00002335 InChI Key: KIIIPQXXLVCCQP-UHFFFAOYSA-N Synonym: phenol, 4-propoxy,4-n-propoxyphenol,p-propoxyphenol,phenol, p-propoxy,hydroquinone monopropyl ether,p-propoxy phenol,4-propyloxyphenol,4-propoxy-phenol,pubchem13204,para-propoxyphenol PubChem CID: 29352 IUPAC Name: 4-propoxyphenol SMILES: CCCOC1=CC=C(C=C1)O

PubChem CID 29352
CAS 18979-50-5
Molecular Weight (g/mol) 152.193
MDL Number MFCD00002335
SMILES CCCOC1=CC=C(C=C1)O
Synonym phenol, 4-propoxy,4-n-propoxyphenol,p-propoxyphenol,phenol, p-propoxy,hydroquinone monopropyl ether,p-propoxy phenol,4-propyloxyphenol,4-propoxy-phenol,pubchem13204,para-propoxyphenol
IUPAC Name 4-propoxyphenol
InChI Key KIIIPQXXLVCCQP-UHFFFAOYSA-N
Molecular Formula C9H12O2
997
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3-Chlorophenylacetone, 94%

CAS: 14123-60-5 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00082872 InChI Key: VCNYPJMEQHTAHS-UHFFFAOYSA-N PubChem CID: 2734097 IUPAC Name: 1-(3-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC(Cl)=C1

PubChem CID 2734097
CAS 14123-60-5
Molecular Weight (g/mol) 168.62
MDL Number MFCD00082872
SMILES CC(=O)CC1=CC=CC(Cl)=C1
IUPAC Name 1-(3-chlorophenyl)propan-2-one
InChI Key VCNYPJMEQHTAHS-UHFFFAOYSA-N
Molecular Formula C9H9ClO
999
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4-(Trifluoromethyl)benzoyl chloride, 97%

CAS: 329-15-7 Molecular Formula: C8H4ClF3O Molecular Weight (g/mol): 208.56 MDL Number: MFCD00000694 InChI Key: OXZYBOLWRXENKT-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzoyl chloride,p-trifluoromethyl benzoyl chloride,p-trifluoromethylbenzoyl chloride,benzoyl chloride, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-toluoyl chloride,4-trifluoromethyl benzoylchloride,p-trifluoromethyl benzoic acid chloride,ptf-boc,4-trifluoromethylbenzoylchloride,4-trifluoromethyl-benzoyl chloride PubChem CID: 67607 IUPAC Name: 4-(trifluoromethyl)benzoyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)C(Cl)=O

PubChem CID 67607
CAS 329-15-7
Molecular Weight (g/mol) 208.56
MDL Number MFCD00000694
SMILES FC(F)(F)C1=CC=C(C=C1)C(Cl)=O
Synonym 4-trifluoromethyl benzoyl chloride,p-trifluoromethyl benzoyl chloride,p-trifluoromethylbenzoyl chloride,benzoyl chloride, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-toluoyl chloride,4-trifluoromethyl benzoylchloride,p-trifluoromethyl benzoic acid chloride,ptf-boc,4-trifluoromethylbenzoylchloride,4-trifluoromethyl-benzoyl chloride
IUPAC Name 4-(trifluoromethyl)benzoyl chloride
InChI Key OXZYBOLWRXENKT-UHFFFAOYSA-N
Molecular Formula C8H4ClF3O
1,000
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4-Chlorobenzyl chloride, 99+%

CAS: 104-83-6 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.03 MDL Number: MFCD00000914 InChI Key: JQZAEUFPPSRDOP-UHFFFAOYSA-N Synonym: 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro PubChem CID: 7723 IUPAC Name: 1-chloro-4-(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)Cl

PubChem CID 7723
CAS 104-83-6
Molecular Weight (g/mol) 161.03
MDL Number MFCD00000914
SMILES C1=CC(=CC=C1CCl)Cl
Synonym 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro
IUPAC Name 1-chloro-4-(chloromethyl)benzene
InChI Key JQZAEUFPPSRDOP-UHFFFAOYSA-N
Molecular Formula C7H6Cl2
1,001
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4-Biphenylacetonitrile, 97%, Thermo Scientific Chemicals

CAS: 31603-77-7 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.25 MDL Number: MFCD00016403 InChI Key: HSZCNGTZJWZAMF-UHFFFAOYSA-N Synonym: 4-biphenylacetonitrile,2-1,1'-biphenyl-4-yl acetonitrile,2-4-phenylphenyl acetonitrile,1,1'-biphenyl-4-acetonitrile,4-cyanomethylbiphenyl,p-biphenylacetonitrile,p-biphenylylacetonitrile,4-biphenyl-acetonitrile,4-biphenylylacetonitrile,p-phenyl benzyl cyanide PubChem CID: 35856 IUPAC Name: 2-(4-phenylphenyl)acetonitrile SMILES: N#CCC1=CC=C(C=C1)C1=CC=CC=C1

PubChem CID 35856
CAS 31603-77-7
Molecular Weight (g/mol) 193.25
MDL Number MFCD00016403
SMILES N#CCC1=CC=C(C=C1)C1=CC=CC=C1
Synonym 4-biphenylacetonitrile,2-1,1'-biphenyl-4-yl acetonitrile,2-4-phenylphenyl acetonitrile,1,1'-biphenyl-4-acetonitrile,4-cyanomethylbiphenyl,p-biphenylacetonitrile,p-biphenylylacetonitrile,4-biphenyl-acetonitrile,4-biphenylylacetonitrile,p-phenyl benzyl cyanide
IUPAC Name 2-(4-phenylphenyl)acetonitrile
InChI Key HSZCNGTZJWZAMF-UHFFFAOYSA-N
Molecular Formula C14H11N
1,002
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Tetraphenylphosphonium Bromide, Spectrum™ Chemical
SDP

CAS: 2751-90-8

CAS 2751-90-8
1,003
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3-Methoxybenzyl bromide, 98+%

CAS: 874-98-6 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00216590 InChI Key: ZKSOJQDNSNJIQW-UHFFFAOYSA-N Synonym: 3-methoxybenzyl bromide,1-bromomethyl-3-methoxybenzene,3-methoxybenzylbromide,3-methoxybenzylbromid,m-methoxybenzyl bromide,1-bromomethyl-3-methoxy-benzene,3-bromomethyl-1-methoxybenzene,benzene, 1-bromomethyl-3-methoxy,3-methoxy benzylbromide PubChem CID: 4067207 IUPAC Name: 1-(bromomethyl)-3-methoxybenzene SMILES: COC1=CC=CC(=C1)CBr

PubChem CID 4067207
CAS 874-98-6
Molecular Weight (g/mol) 201.06
MDL Number MFCD00216590
SMILES COC1=CC=CC(=C1)CBr
Synonym 3-methoxybenzyl bromide,1-bromomethyl-3-methoxybenzene,3-methoxybenzylbromide,3-methoxybenzylbromid,m-methoxybenzyl bromide,1-bromomethyl-3-methoxy-benzene,3-bromomethyl-1-methoxybenzene,benzene, 1-bromomethyl-3-methoxy,3-methoxy benzylbromide
IUPAC Name 1-(bromomethyl)-3-methoxybenzene
InChI Key ZKSOJQDNSNJIQW-UHFFFAOYSA-N
Molecular Formula C8H9BrO
1,004
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4,5-Dihydroxynaphthalene-2,7-disulfonic acid, disodium salt dihydrate, Thermo Scientific Chemicals

CAS: 5808-22-0 Molecular Formula: C10H10Na2O10S2 Molecular Weight (g/mol): 400.28 MDL Number: MFCD00150612 InChI Key: QUEAKWJKJBFNEG-UHFFFAOYSA-L Synonym: 1,8-Dihydroxynaphthalene-3,6-disulfonic acid, disodium salt dihydrate; Chromotropic acid, disodium salt dihydrate IUPAC Name: 2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate SMILES: O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na]

CAS 5808-22-0
Molecular Weight (g/mol) 400.28
MDL Number MFCD00150612
SMILES O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na]
Synonym 1,8-Dihydroxynaphthalene-3,6-disulfonic acid, disodium salt dihydrate; Chromotropic acid, disodium salt dihydrate
IUPAC Name 2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate
InChI Key QUEAKWJKJBFNEG-UHFFFAOYSA-L
Molecular Formula C10H10Na2O10S2
1,005
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2,6-Difluorophenylacetone, 98%, Thermo Scientific™

CAS: 101712-20-3 Molecular Formula: C9H8F2O Molecular Weight (g/mol): 170.16 InChI Key: LAWHOFKPDMZDLJ-UHFFFAOYSA-N Synonym: 1-2,6-difluorophenyl propan-2-one,2-propanone, 1-2,6-difluorophenyl,2,6-difluorophenylacetone PubChem CID: 2734927 IUPAC Name: 1-(2,6-difluorophenyl)propan-2-one SMILES: CC(=O)CC1=C(C=CC=C1F)F

PubChem CID 2734927
CAS 101712-20-3
Molecular Weight (g/mol) 170.16
SMILES CC(=O)CC1=C(C=CC=C1F)F
Synonym 1-2,6-difluorophenyl propan-2-one,2-propanone, 1-2,6-difluorophenyl,2,6-difluorophenylacetone
IUPAC Name 1-(2,6-difluorophenyl)propan-2-one
InChI Key LAWHOFKPDMZDLJ-UHFFFAOYSA-N
Molecular Formula C9H8F2O