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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 (129,916)
Phenols (25,079)
Naphthalenes (6,360)
Phenol esters (4,812)
Unsubstituted Phenols (1,436)
Fluorenes (1,294)
Thiophenols (761)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (336)
Pyrenes (277)
Triphenyl compounds (277)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (22)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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3,361 – 3,375 of 158,802 results
3,361
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4-Chlorothiophenol, 97%

CAS: 106-54-7 Molecular Formula: C6H5ClS Molecular Weight (g/mol): 144.616 MDL Number: MFCD00004847 InChI Key: VZXOZSQDJJNBRC-UHFFFAOYSA-N Synonym: 4-chlorothiophenol,p-chlorothiophenol,benzenethiol, 4-chloro,p-chlorobenzenethiol,p-chlorthiofenol,p-chlorophenylmercaptan,benzenethiol, p-chloro,p-mercaptochlorobenzene,4-chlorophenylmercaptan,1-chloro-4-mercaptobenzene PubChem CID: 7815 IUPAC Name: 4-chlorobenzenethiol SMILES: C1=CC(=CC=C1S)Cl

PubChem CID 7815
CAS 106-54-7
Molecular Weight (g/mol) 144.616
MDL Number MFCD00004847
SMILES C1=CC(=CC=C1S)Cl
Synonym 4-chlorothiophenol,p-chlorothiophenol,benzenethiol, 4-chloro,p-chlorobenzenethiol,p-chlorthiofenol,p-chlorophenylmercaptan,benzenethiol, p-chloro,p-mercaptochlorobenzene,4-chlorophenylmercaptan,1-chloro-4-mercaptobenzene
IUPAC Name 4-chlorobenzenethiol
InChI Key VZXOZSQDJJNBRC-UHFFFAOYSA-N
Molecular Formula C6H5ClS
3,362
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4-Chlorothiophenol, 98%

CAS: 106-54-7 MDL Number: MFCD00004847 InChI Key: VZXOZSQDJJNBRC-UHFFFAOYSA-N Synonym: 4-chlorothiophenol,p-chlorothiophenol,benzenethiol, 4-chloro,p-chlorobenzenethiol,p-chlorthiofenol,p-chlorophenylmercaptan,benzenethiol, p-chloro,p-mercaptochlorobenzene,4-chlorophenylmercaptan,1-chloro-4-mercaptobenzene PubChem CID: 7815 IUPAC Name: 4-chlorobenzenethiol SMILES: C1=CC(=CC=C1S)Cl

PubChem CID 7815
CAS 106-54-7
MDL Number MFCD00004847
SMILES C1=CC(=CC=C1S)Cl
Synonym 4-chlorothiophenol,p-chlorothiophenol,benzenethiol, 4-chloro,p-chlorobenzenethiol,p-chlorthiofenol,p-chlorophenylmercaptan,benzenethiol, p-chloro,p-mercaptochlorobenzene,4-chlorophenylmercaptan,1-chloro-4-mercaptobenzene
IUPAC Name 4-chlorobenzenethiol
InChI Key VZXOZSQDJJNBRC-UHFFFAOYSA-N
3,363
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1,3,5-Tri-tert-butylbenzene, 97+%

CAS: 1460-02-2 Molecular Formula: C18H30 Molecular Weight (g/mol): 246.438 MDL Number: MFCD00008831 InChI Key: GUFMBISUSZUUCB-UHFFFAOYSA-N Synonym: 1,3,5-tri-tert-butylbenzene,benzene, 1,3,5-tris 1,1-dimethylethyl,1,3,5-tri-t-butylbenzene,benzene, 1,3,5-tri-tert-butyl,1,3,5-tris tert-butyl benzene,pubchem13719,intermediates-zcf02115,acmc-209cw6,2,4,6-tri-tert-butylphenyl,ksc490m7l PubChem CID: 15089 IUPAC Name: 1,3,5-tritert-butylbenzene SMILES: CC(C)(C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

PubChem CID 15089
CAS 1460-02-2
Molecular Weight (g/mol) 246.438
MDL Number MFCD00008831
SMILES CC(C)(C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
Synonym 1,3,5-tri-tert-butylbenzene,benzene, 1,3,5-tris 1,1-dimethylethyl,1,3,5-tri-t-butylbenzene,benzene, 1,3,5-tri-tert-butyl,1,3,5-tris tert-butyl benzene,pubchem13719,intermediates-zcf02115,acmc-209cw6,2,4,6-tri-tert-butylphenyl,ksc490m7l
IUPAC Name 1,3,5-tritert-butylbenzene
InChI Key GUFMBISUSZUUCB-UHFFFAOYSA-N
Molecular Formula C18H30
3,364

TraceCERT™ Lilial, 2000 μg/mL, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

3,365
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4-Fluorophenylacetone, 99%

CAS: 459-03-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD00000362 InChI Key: ZUEKIIWSVFBTCM-UHFFFAOYSA-N Synonym: 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one PubChem CID: 521187 IUPAC Name: 1-(4-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(F)C=C1

PubChem CID 521187
CAS 459-03-0
Molecular Weight (g/mol) 152.17
MDL Number MFCD00000362
SMILES CC(=O)CC1=CC=C(F)C=C1
Synonym 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one
IUPAC Name 1-(4-fluorophenyl)propan-2-one
InChI Key ZUEKIIWSVFBTCM-UHFFFAOYSA-N
Molecular Formula C9H9FO
3,366
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5-tert-Butyl-m-xylene, 98%

CAS: 98-19-1 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00008832 InChI Key: FZSPYHREEHYLCB-UHFFFAOYSA-N Synonym: 5-tert-butyl-m-xylene,1-tert-butyl-3,5-dimethylbenzene,m-xylene, 5-tert-butyl,1,3-dimethyl-5-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-3,5-dimethyl,5-tert-butyl-1,3-dimethylbenzene,benzene, 5-tert-butyl-1,3-dimethyl,1,3-dimethyl-5-t-butylbenzene,5-t-butyl-1,3-dimethylbenzene,benzene, 1,3-dimethyl-5-1,1-dimethylethyl PubChem CID: 7378 IUPAC Name: 1-tert-butyl-3,5-dimethylbenzene SMILES: CC1=CC(=CC(=C1)C(C)(C)C)C

PubChem CID 7378
CAS 98-19-1
Molecular Weight (g/mol) 162.276
MDL Number MFCD00008832
SMILES CC1=CC(=CC(=C1)C(C)(C)C)C
Synonym 5-tert-butyl-m-xylene,1-tert-butyl-3,5-dimethylbenzene,m-xylene, 5-tert-butyl,1,3-dimethyl-5-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-3,5-dimethyl,5-tert-butyl-1,3-dimethylbenzene,benzene, 5-tert-butyl-1,3-dimethyl,1,3-dimethyl-5-t-butylbenzene,5-t-butyl-1,3-dimethylbenzene,benzene, 1,3-dimethyl-5-1,1-dimethylethyl
IUPAC Name 1-tert-butyl-3,5-dimethylbenzene
InChI Key FZSPYHREEHYLCB-UHFFFAOYSA-N
Molecular Formula C12H18
3,367
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2,4-Difluorophenylacetone, 98%

CAS: 274682-91-6 Molecular Formula: C9H8F2O Molecular Weight (g/mol): 170.16 MDL Number: MFCD02258866 InChI Key: XVHHDTNIOCSTLH-UHFFFAOYSA-N Synonym: 1-2,4-difluorophenyl propan-2-one,2,4-difluorophenylacetone,2-propanone, 1-2,4-difluorophenyl,2,4-difluorophenyl propanone,1-2,4-difluorophenyl-2-propanone,1-2,4-difluoro-phenyl-propane-2-one PubChem CID: 2734881 IUPAC Name: 1-(2,4-difluorophenyl)propan-2-one SMILES: CC(=O)CC1=C(C=C(C=C1)F)F

PubChem CID 2734881
CAS 274682-91-6
Molecular Weight (g/mol) 170.16
MDL Number MFCD02258866
SMILES CC(=O)CC1=C(C=C(C=C1)F)F
Synonym 1-2,4-difluorophenyl propan-2-one,2,4-difluorophenylacetone,2-propanone, 1-2,4-difluorophenyl,2,4-difluorophenyl propanone,1-2,4-difluorophenyl-2-propanone,1-2,4-difluoro-phenyl-propane-2-one
IUPAC Name 1-(2,4-difluorophenyl)propan-2-one
InChI Key XVHHDTNIOCSTLH-UHFFFAOYSA-N
Molecular Formula C9H8F2O
3,368
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4-Bromophenylacetone, 97%

CAS: 6186-22-7 Molecular Formula: C24H24N2O5S Molecular Weight (g/mol): 452.53 MDL Number: MFCD00210401 InChI Key: CDUPPXGKUKTGLU-UHFFFAOYSA-N Synonym: 4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone PubChem CID: 736332 SMILES: COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1

PubChem CID 736332
CAS 6186-22-7
Molecular Weight (g/mol) 452.53
MDL Number MFCD00210401
SMILES COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1
Synonym 4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone
InChI Key CDUPPXGKUKTGLU-UHFFFAOYSA-N
Molecular Formula C24H24N2O5S
3,369
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Fenofibrate, BP, EP, 98-102%, Spectrum™ Chemical

CAS: 49562-28-9 Molecular Formula: C20H21ClO4 Molecular Weight (g/mol): 360.83 InChI Key: YMTINGFKWWXKFG-UHFFFAOYSA-N IUPAC Name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate SMILES: CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1

CAS 49562-28-9
Molecular Weight (g/mol) 360.83
SMILES CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1
IUPAC Name propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate
InChI Key YMTINGFKWWXKFG-UHFFFAOYSA-N
Molecular Formula C20H21ClO4
3,370
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1,2-Benzenedithiol, 96%

CAS: 17534-15-5 Molecular Formula: C6H6S2 Molecular Weight (g/mol): 142.23 MDL Number: MFCD00004835 InChI Key: JRNVQLOKVMWBFR-UHFFFAOYSA-N Synonym: 1,2-benzenedithiol,benzenedithiol,1,2-dimercaptobenzene,dithiocatechol,dimercaptobenzene,o-benzenedithiol,acmc-209e9y,1,2-benzenedithiol 9ci,benzene-1,2-dithiol PubChem CID: 69370 IUPAC Name: benzene-1,2-dithiol SMILES: SC1=C(S)C=CC=C1

PubChem CID 69370
CAS 17534-15-5
Molecular Weight (g/mol) 142.23
MDL Number MFCD00004835
SMILES SC1=C(S)C=CC=C1
Synonym 1,2-benzenedithiol,benzenedithiol,1,2-dimercaptobenzene,dithiocatechol,dimercaptobenzene,o-benzenedithiol,acmc-209e9y,1,2-benzenedithiol 9ci,benzene-1,2-dithiol
IUPAC Name benzene-1,2-dithiol
InChI Key JRNVQLOKVMWBFR-UHFFFAOYSA-N
Molecular Formula C6H6S2
3,371
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Thiophenol, Approx. 97%, Spectrum™ Chemical

T2260, 108-98-5, C6H6S

Boiling Point 168 to 169°C
Percent Purity ∼97%
CAS 108-98-5
Physical Form Liquid
Packaging Amber Glass Bottle
Grade Reagent
CAS Max % 1
3,372
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2-Bromothiophenol, 97%

CAS: 6320-02-1 Molecular Formula: C6H5BrS Molecular Weight (g/mol): 189.07 MDL Number: MFCD00004827 InChI Key: YUQUNWNSQDULTI-UHFFFAOYSA-N Synonym: 2-chlorothiophenol,o-chlorothiophenol,benzenethiol, 2-chloro,1-chloro-2-mercaptobenzene,o-chlorobenzenethiol,o-chloromercaptobenzene,chlorothiophenol,benzenethiol, o-chloro,2-chlorobenzene-1-thiol,2-chloro thiophenol PubChem CID: 80599 SMILES: SC1=CC=CC=C1Br

PubChem CID 80599
CAS 6320-02-1
Molecular Weight (g/mol) 189.07
MDL Number MFCD00004827
SMILES SC1=CC=CC=C1Br
Synonym 2-chlorothiophenol,o-chlorothiophenol,benzenethiol, 2-chloro,1-chloro-2-mercaptobenzene,o-chlorobenzenethiol,o-chloromercaptobenzene,chlorothiophenol,benzenethiol, o-chloro,2-chlorobenzene-1-thiol,2-chloro thiophenol
InChI Key YUQUNWNSQDULTI-UHFFFAOYSA-N
Molecular Formula C6H5BrS
3,373
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3-(Methylthio)aniline, 97%

CAS: 1783-81-9 Molecular Formula: C7H9NS Molecular Weight (g/mol): 139.216 MDL Number: MFCD00007793 InChI Key: KCHLDNLIJVSRPK-UHFFFAOYSA-N Synonym: 3-methylthio aniline,3-aminothioanisole,m-aminothioanisole,m-methylthio aniline,benzenamine, 3-methylthio,3-methylmercapto aniline,3-methylsulfanyl aniline,3-methylmercaptoaniline,3-methylthiobenzenamine,m-aminophenyl methyl sulfide PubChem CID: 15693 IUPAC Name: 3-methylsulfanylaniline SMILES: CSC1=CC=CC(=C1)N

PubChem CID 15693
CAS 1783-81-9
Molecular Weight (g/mol) 139.216
MDL Number MFCD00007793
SMILES CSC1=CC=CC(=C1)N
Synonym 3-methylthio aniline,3-aminothioanisole,m-aminothioanisole,m-methylthio aniline,benzenamine, 3-methylthio,3-methylmercapto aniline,3-methylsulfanyl aniline,3-methylmercaptoaniline,3-methylthiobenzenamine,m-aminophenyl methyl sulfide
IUPAC Name 3-methylsulfanylaniline
InChI Key KCHLDNLIJVSRPK-UHFFFAOYSA-N
Molecular Formula C7H9NS
3,374
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3,5-Dimethylthiophenol, 97%

CAS: 38360-81-5 Molecular Formula: C8H10S Molecular Weight (g/mol): 138.228 MDL Number: MFCD00040226 InChI Key: CESBAYSBPMVAEI-UHFFFAOYSA-N Synonym: 3,5-dimethylthiophenol,benzenethiol, 3,5-dimethyl,3,5-dimethylbenzene-1-thiol,3,5-dimethyl thiophenol,m-xylene-5-thiol,5-mercapto-m-xylene,3,5-xylenethiol,xylenethiol, mixed isomers,3,5dimethylthiophenol,pubchem6885 PubChem CID: 117548 IUPAC Name: 3,5-dimethylbenzenethiol SMILES: CC1=CC(=CC(=C1)S)C

PubChem CID 117548
CAS 38360-81-5
Molecular Weight (g/mol) 138.228
MDL Number MFCD00040226
SMILES CC1=CC(=CC(=C1)S)C
Synonym 3,5-dimethylthiophenol,benzenethiol, 3,5-dimethyl,3,5-dimethylbenzene-1-thiol,3,5-dimethyl thiophenol,m-xylene-5-thiol,5-mercapto-m-xylene,3,5-xylenethiol,xylenethiol, mixed isomers,3,5dimethylthiophenol,pubchem6885
IUPAC Name 3,5-dimethylbenzenethiol
InChI Key CESBAYSBPMVAEI-UHFFFAOYSA-N
Molecular Formula C8H10S
3,375
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4-Bromothiophenol, 98%

CAS: 106-53-6 Molecular Formula: C6H5BrS Molecular Weight (g/mol): 189.07 MDL Number: MFCD00004845 InChI Key: FTBCOQFMQSTCQQ-UHFFFAOYSA-N Synonym: 4-bromothiophenol,benzenethiol, 4-bromo,p-bromothiophenol,p-bromobenzenethiol,4-bromobenzene-1-thiol,4-bromo-benzenethiol,4-bromo thiophenol,p-bromophenyl thiol,benzenethiol, p-bromo,unii-p3wuo03x17 PubChem CID: 66049 IUPAC Name: 4-bromobenzenethiol SMILES: C1=CC(=CC=C1S)Br

PubChem CID 66049
CAS 106-53-6
Molecular Weight (g/mol) 189.07
MDL Number MFCD00004845
SMILES C1=CC(=CC=C1S)Br
Synonym 4-bromothiophenol,benzenethiol, 4-bromo,p-bromothiophenol,p-bromobenzenethiol,4-bromobenzene-1-thiol,4-bromo-benzenethiol,4-bromo thiophenol,p-bromophenyl thiol,benzenethiol, p-bromo,unii-p3wuo03x17
IUPAC Name 4-bromobenzenethiol
InChI Key FTBCOQFMQSTCQQ-UHFFFAOYSA-N
Molecular Formula C6H5BrS