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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 (67,607)
Phenols (13,420)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (557)
Anthracenes (412)
Phenanthrenes and derivatives (327)
Tetralins (327)
Indanes (313)
Triphenyl compounds (277)
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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Keyword Search:
826 – 840 of 78,418 results
826

2-Bromo-1,3,5-trimethyl-4-nitrobenzene, 90+%

CAS: 90561-85-6 Molecular Formula: C9H10BrNO2 Molecular Weight (g/mol): 244.088 MDL Number: MFCD00015924 InChI Key: IUFDRRDWXUSFBG-UHFFFAOYSA-N Synonym: 3-bromo-2,4,6-trimethylnitrobenzene,2-bromo-4-nitro-1,3,5-trimethylbenzene,1-bromo-3-nitro-2,4,6-trimethylbenzene,4-bromo-2-nitromesitylene,4-bromo-1,3,5-trimethyl-2-nitrobenzene,2-bromanyl-1,3,5-trimethyl-4-nitro-benzene PubChem CID: 2757200 IUPAC Name: 2-bromo-1,3,5-trimethyl-4-nitrobenzene SMILES: CC1=CC(=C(C(=C1[N+](=O)[O-])C)Br)C

PubChem CID 2757200
CAS 90561-85-6
Molecular Weight (g/mol) 244.088
MDL Number MFCD00015924
SMILES CC1=CC(=C(C(=C1[N+](=O)[O-])C)Br)C
Synonym 3-bromo-2,4,6-trimethylnitrobenzene,2-bromo-4-nitro-1,3,5-trimethylbenzene,1-bromo-3-nitro-2,4,6-trimethylbenzene,4-bromo-2-nitromesitylene,4-bromo-1,3,5-trimethyl-2-nitrobenzene,2-bromanyl-1,3,5-trimethyl-4-nitro-benzene
IUPAC Name 2-bromo-1,3,5-trimethyl-4-nitrobenzene
InChI Key IUFDRRDWXUSFBG-UHFFFAOYSA-N
Molecular Formula C9H10BrNO2
827

4-Bromo-3-nitrotoluene, 98+%

CAS: 5326-34-1 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.03 MDL Number: MFCD00024180 InChI Key: UPBUTKQMDPHQAQ-UHFFFAOYSA-N Synonym: 4-bromo-3-nitrotoluene,2-bromo-5-methylnitrobenzene,benzene, 1-bromo-4-methyl-2-nitro,bromonitrotoluene-4,1-bromo-4-methyl-2-nitro-benzene,3-nitro-4-bromotoluene,pubchem9585,acmc-209l5d,ksc490m7t,tpc-i121 PubChem CID: 79224 IUPAC Name: 1-bromo-4-methyl-2-nitrobenzene SMILES: CC1=CC=C(Br)C(=C1)[N+]([O-])=O

PubChem CID 79224
CAS 5326-34-1
Molecular Weight (g/mol) 216.03
MDL Number MFCD00024180
SMILES CC1=CC=C(Br)C(=C1)[N+]([O-])=O
Synonym 4-bromo-3-nitrotoluene,2-bromo-5-methylnitrobenzene,benzene, 1-bromo-4-methyl-2-nitro,bromonitrotoluene-4,1-bromo-4-methyl-2-nitro-benzene,3-nitro-4-bromotoluene,pubchem9585,acmc-209l5d,ksc490m7t,tpc-i121
IUPAC Name 1-bromo-4-methyl-2-nitrobenzene
InChI Key UPBUTKQMDPHQAQ-UHFFFAOYSA-N
Molecular Formula C7H6BrNO2
828

3-Fluoro-4-nitrotoluene, 99%

CAS: 446-34-4 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.13 MDL Number: MFCD00007053 InChI Key: WZMOWQCNPFDWPA-UHFFFAOYSA-N Synonym: 3-fluoro-4-nitrotoluene,benzene, 2-fluoro-4-methyl-1-nitro,2-fluoro-4-methylnitrobenzene,2-fluoro-4-methyl-1-nitro-benzene,3-fluoro-4-nitrobenzene,2-fluor-4-methyl-1-nitrobenzol,pubchem1595,3-fluoro4-nitrotoluene,acmc-1alaq,3-fluoro-4-nitro toluene PubChem CID: 67966 IUPAC Name: 2-fluoro-4-methyl-1-nitrobenzene SMILES: CC1=CC=C(C(F)=C1)[N+]([O-])=O

PubChem CID 67966
CAS 446-34-4
Molecular Weight (g/mol) 155.13
MDL Number MFCD00007053
SMILES CC1=CC=C(C(F)=C1)[N+]([O-])=O
Synonym 3-fluoro-4-nitrotoluene,benzene, 2-fluoro-4-methyl-1-nitro,2-fluoro-4-methylnitrobenzene,2-fluoro-4-methyl-1-nitro-benzene,3-fluoro-4-nitrobenzene,2-fluor-4-methyl-1-nitrobenzol,pubchem1595,3-fluoro4-nitrotoluene,acmc-1alaq,3-fluoro-4-nitro toluene
IUPAC Name 2-fluoro-4-methyl-1-nitrobenzene
InChI Key WZMOWQCNPFDWPA-UHFFFAOYSA-N
Molecular Formula C7H6FNO2
829

p-Toluic hydrazide, 98%, Thermo Scientific Chemicals

CAS: 3619-22-5 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.18 MDL Number: MFCD00007607 InChI Key: MFFVZXOPRXMVET-UHFFFAOYSA-N Synonym: p-toluic hydrazide,p-toluic acid hydrazide,p-toluoylhydrazine,4-methylbenzoylhydrazine,p-toluic acid, hydrazide,4-methylbenzoic acid hydrazide,p-methylbenzohydrazide,p-toluohydrazide,p-methylbenzoylhydrazine,4-toluic acid hydrazide PubChem CID: 77174 IUPAC Name: 4-methylbenzohydrazide SMILES: CC1=CC=C(C=C1)C(=O)NN

PubChem CID 77174
CAS 3619-22-5
Molecular Weight (g/mol) 150.18
MDL Number MFCD00007607
SMILES CC1=CC=C(C=C1)C(=O)NN
Synonym p-toluic hydrazide,p-toluic acid hydrazide,p-toluoylhydrazine,4-methylbenzoylhydrazine,p-toluic acid, hydrazide,4-methylbenzoic acid hydrazide,p-methylbenzohydrazide,p-toluohydrazide,p-methylbenzoylhydrazine,4-toluic acid hydrazide
IUPAC Name 4-methylbenzohydrazide
InChI Key MFFVZXOPRXMVET-UHFFFAOYSA-N
Molecular Formula C8H10N2O
830

1-(2,3-Dihydrobenzo[b]furan-5-yl)ethan-1-one, 97%, Thermo Scientific™

CAS: 90843-31-5 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00068033 InChI Key: MMVUJVASBDVNGJ-UHFFFAOYSA-N Synonym: 5-acetyl-2,3-dihydrobenzo b furan,5-acetyl-2,3-dihydrobenzofuran,1-2,3-dihydro-1-benzofuran-5-yl ethanone,1-2,3-dihydrobenzofuran-5-yl ethanone,1-2,3-dihydrobenzo b furan-5-yl ethan-1-one,1-2,3-dihydro-benzofuran-5-yl-ethanone,1-2,3-dihydro-5-benzofuranyl ethanone,1-2,3-dihydro-1-benzofuran-5-yl ethan-1-one,5-acetyl-2,3-dihydro-1-benzofuran PubChem CID: 145220 IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-yl)ethanone SMILES: CC(=O)C1=CC=C2OCCC2=C1

PubChem CID 145220
CAS 90843-31-5
Molecular Weight (g/mol) 162.19
MDL Number MFCD00068033
SMILES CC(=O)C1=CC=C2OCCC2=C1
Synonym 5-acetyl-2,3-dihydrobenzo b furan,5-acetyl-2,3-dihydrobenzofuran,1-2,3-dihydro-1-benzofuran-5-yl ethanone,1-2,3-dihydrobenzofuran-5-yl ethanone,1-2,3-dihydrobenzo b furan-5-yl ethan-1-one,1-2,3-dihydro-benzofuran-5-yl-ethanone,1-2,3-dihydro-5-benzofuranyl ethanone,1-2,3-dihydro-1-benzofuran-5-yl ethan-1-one,5-acetyl-2,3-dihydro-1-benzofuran
IUPAC Name 1-(2,3-dihydro-1-benzofuran-5-yl)ethanone
InChI Key MMVUJVASBDVNGJ-UHFFFAOYSA-N
Molecular Formula C10H10O2
831

(+)-Usnic acid, 98%

CAS: 7562-61-0 Molecular Formula: C18H16O7 Molecular Weight (g/mol): 344.32 MDL Number: MFCD00016878,MFCD00065294 InChI Key: CUCUKLJLRRAKFN-KKIBXBACSA-N Synonym: +-usnic acid,d-usninic acid,r-usnic acid,r-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyl-9bh-dibenzofuran-1-one,+-usnic acid from usnea dasypoga,--usnic acid,9br-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo b,d furan-1 9bh-one,r-+-usnic acid,unii-0w584pfj77 component,9br-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyl-1-dibenzofuranone PubChem CID: 478125 ChEBI: CHEBI:38320 IUPAC Name: (9bR)-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzofuran-1-one SMILES: CC(=O)C1C(=O)C=C2OC3=C(C(C)=O)C(O)=C(C)C(O)=C3[C@]2(C)C1=O

PubChem CID 478125
CAS 7562-61-0
Molecular Weight (g/mol) 344.32
ChEBI CHEBI:38320
MDL Number MFCD00016878,MFCD00065294
SMILES CC(=O)C1C(=O)C=C2OC3=C(C(C)=O)C(O)=C(C)C(O)=C3[C@]2(C)C1=O
Synonym +-usnic acid,d-usninic acid,r-usnic acid,r-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyl-9bh-dibenzofuran-1-one,+-usnic acid from usnea dasypoga,--usnic acid,9br-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo b,d furan-1 9bh-one,r-+-usnic acid,unii-0w584pfj77 component,9br-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyl-1-dibenzofuranone
IUPAC Name (9bR)-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzofuran-1-one
InChI Key CUCUKLJLRRAKFN-KKIBXBACSA-N
Molecular Formula C18H16O7
832

2'-Acetonaphthone, 99%

CAS: 93-08-3 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.21 MDL Number: MFCD00004108 InChI Key: XSAYZAUNJMRRIR-UHFFFAOYSA-N Synonym: 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone PubChem CID: 7122 ChEBI: CHEBI:52364 IUPAC Name: 1-naphthalen-2-ylethanone SMILES: CC(=O)C1=CC2=CC=CC=C2C=C1

PubChem CID 7122
CAS 93-08-3
Molecular Weight (g/mol) 170.21
ChEBI CHEBI:52364
MDL Number MFCD00004108
SMILES CC(=O)C1=CC2=CC=CC=C2C=C1
Synonym 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone
IUPAC Name 1-naphthalen-2-ylethanone
InChI Key XSAYZAUNJMRRIR-UHFFFAOYSA-N
Molecular Formula C12H10O
833

6-Acetyl-2(3H)-benzoxazolone, 97%, Thermo Scientific Chemicals

CAS: 54903-09-2 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD01664312 InChI Key: QXBNAXVXLAHDTE-UHFFFAOYSA-N Synonym: 6-acetyl-2 3h-benzoxazolone,2 3h-benzoxazolone, 6-acetyl,jpb 2,6-acetyl-2-benzoxazolinone,6-acetylbenzo d oxazol-2 3h-one,6-acetyl-2,3-dihydro-1,3-benzoxazol-2-one,acetyl-6 benzoxazolinone french,6-acetyl-3h-benzooxazol-2-one,6-acetyl-1,3-benzoxazol-2 3h-one,6-acetyl-2-oxo-3-hydrobenzoxazole PubChem CID: 689054 IUPAC Name: 6-acetyl-3H-1,3-benzoxazol-2-one SMILES: CC(=O)C1=CC2=C(C=C1)NC(=O)O2

PubChem CID 689054
CAS 54903-09-2
Molecular Weight (g/mol) 177.159
MDL Number MFCD01664312
SMILES CC(=O)C1=CC2=C(C=C1)NC(=O)O2
Synonym 6-acetyl-2 3h-benzoxazolone,2 3h-benzoxazolone, 6-acetyl,jpb 2,6-acetyl-2-benzoxazolinone,6-acetylbenzo d oxazol-2 3h-one,6-acetyl-2,3-dihydro-1,3-benzoxazol-2-one,acetyl-6 benzoxazolinone french,6-acetyl-3h-benzooxazol-2-one,6-acetyl-1,3-benzoxazol-2 3h-one,6-acetyl-2-oxo-3-hydrobenzoxazole
IUPAC Name 6-acetyl-3H-1,3-benzoxazol-2-one
InChI Key QXBNAXVXLAHDTE-UHFFFAOYSA-N
Molecular Formula C9H7NO3
834

4-Butylacetophenone, Spectrum™ Chemical
SDP

CAS: 37920-25-5

CAS 37920-25-5
835

2-Acetyl-6-methoxynaphthalene, 98%

CAS: 3900-45-6 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00021643 InChI Key: GGWCZBGAIGGTDA-UHFFFAOYSA-N Synonym: 2-acetyl-6-methoxynaphthalene,1-6-methoxynaphthalen-2-yl ethanone,1-6-methoxy-2-naphthyl ethanone,6-methoxy-2-acetylnaphthalene,unii-61vbh3537c,6'-methoxy-2'-acetonaphthone,1-6-methoxy-2-naphthyl ethan-1-one,ethanone, 1-6-methoxy-2-naphthalenyl,2-acetyl-6-methoxy naphthalene,6-methoxy-2-acetyl naphthalene PubChem CID: 77506 IUPAC Name: 1-(6-methoxynaphthalen-2-yl)ethanone SMILES: CC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC

PubChem CID 77506
CAS 3900-45-6
Molecular Weight (g/mol) 200.237
MDL Number MFCD00021643
SMILES CC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC
Synonym 2-acetyl-6-methoxynaphthalene,1-6-methoxynaphthalen-2-yl ethanone,1-6-methoxy-2-naphthyl ethanone,6-methoxy-2-acetylnaphthalene,unii-61vbh3537c,6'-methoxy-2'-acetonaphthone,1-6-methoxy-2-naphthyl ethan-1-one,ethanone, 1-6-methoxy-2-naphthalenyl,2-acetyl-6-methoxy naphthalene,6-methoxy-2-acetyl naphthalene
IUPAC Name 1-(6-methoxynaphthalen-2-yl)ethanone
InChI Key GGWCZBGAIGGTDA-UHFFFAOYSA-N
Molecular Formula C13H12O2
836

1'-Acetonaphthone, 95%

CAS: 941-98-0 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.21 MDL Number: MFCD00004013 InChI Key: QQLIGMASAVJVON-UHFFFAOYSA-N Synonym: 1'-acetonaphthone,1-acetonaphthone,1-acetylnaphthalene,methyl 1-naphthyl ketone,1-acetonaphthalene,1-1-naphthalenyl ethanone,ethanone, 1-1-naphthalenyl,1-naphthalen-1-yl ethanone,1-naphthyl methyl ketone,alpha-acetonaphthone PubChem CID: 13663 IUPAC Name: 1-naphthalen-1-ylethanone SMILES: CC(=O)C1=CC=CC2=CC=CC=C21

PubChem CID 13663
CAS 941-98-0
Molecular Weight (g/mol) 170.21
MDL Number MFCD00004013
SMILES CC(=O)C1=CC=CC2=CC=CC=C21
Synonym 1'-acetonaphthone,1-acetonaphthone,1-acetylnaphthalene,methyl 1-naphthyl ketone,1-acetonaphthalene,1-1-naphthalenyl ethanone,ethanone, 1-1-naphthalenyl,1-naphthalen-1-yl ethanone,1-naphthyl methyl ketone,alpha-acetonaphthone
IUPAC Name 1-naphthalen-1-ylethanone
InChI Key QQLIGMASAVJVON-UHFFFAOYSA-N
Molecular Formula C12H10O
837

4-(Hexyloxy)benzoic Acid, Spectrum™ Chemical
SDP

CAS: 1142-39-8 Molecular Formula: C13H18O3 Molecular Weight (g/mol): 222.28 InChI Key: HBQUXMZZODHFMJ-UHFFFAOYSA-N IUPAC Name: 4-(hexyloxy)benzoic acid SMILES: CCCCCCOC1=CC=C(C=C1)C(O)=O

CAS 1142-39-8
Molecular Weight (g/mol) 222.28
SMILES CCCCCCOC1=CC=C(C=C1)C(O)=O
IUPAC Name 4-(hexyloxy)benzoic acid
InChI Key HBQUXMZZODHFMJ-UHFFFAOYSA-N
Molecular Formula C13H18O3
838

3,5-Dimethoxytoluene, 98%

CAS: 4179-19-5 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00015435 InChI Key: RIZBLVRXRWHLFA-UHFFFAOYSA-N Synonym: 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i PubChem CID: 77844 IUPAC Name: 1,3-dimethoxy-5-methylbenzene SMILES: COC1=CC(OC)=CC(C)=C1

PubChem CID 77844
CAS 4179-19-5
Molecular Weight (g/mol) 152.19
MDL Number MFCD00015435
SMILES COC1=CC(OC)=CC(C)=C1
Synonym 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i
IUPAC Name 1,3-dimethoxy-5-methylbenzene
InChI Key RIZBLVRXRWHLFA-UHFFFAOYSA-N
Molecular Formula C9H12O2
839

3-(Pyridin-2-yloxy)aniline, 97%, Thermo Scientific™

CAS: 86556-09-4 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD06825506 InChI Key: CLQMOPKXIBQKKG-UHFFFAOYSA-N Synonym: 3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy PubChem CID: 13150573 IUPAC Name: 3-pyridin-2-yloxyaniline SMILES: NC1=CC(OC2=CC=CC=N2)=CC=C1

PubChem CID 13150573
CAS 86556-09-4
Molecular Weight (g/mol) 186.21
MDL Number MFCD06825506
SMILES NC1=CC(OC2=CC=CC=N2)=CC=C1
Synonym 3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy
IUPAC Name 3-pyridin-2-yloxyaniline
InChI Key CLQMOPKXIBQKKG-UHFFFAOYSA-N
Molecular Formula C11H10N2O
840

Phenyl chlorothionoformate, 98+%

CAS: 1005-56-7 Molecular Formula: C7H5ClOS Molecular Weight (g/mol): 172.63 MDL Number: MFCD00004920 InChI Key: KOSYAAIZOGNATQ-UHFFFAOYSA-N Synonym: o-phenyl carbonochloridothioate,phenyl chlorothionoformate,o-phenyl chlorothioformate,phenyl chlorothioformate,phenyl thioxochloroformate,phenyl chlorothionocarbonate,phenoxythiocarbonyl chloride,chlorothioformic acid phenyl ester,o-phenyl chlorothionoformate,o-phenyl chlorothiocarbonate PubChem CID: 70498 SMILES: ClC(=S)OC1=CC=CC=C1

PubChem CID 70498
CAS 1005-56-7
Molecular Weight (g/mol) 172.63
MDL Number MFCD00004920
SMILES ClC(=S)OC1=CC=CC=C1
Synonym o-phenyl carbonochloridothioate,phenyl chlorothionoformate,o-phenyl chlorothioformate,phenyl chlorothioformate,phenyl thioxochloroformate,phenyl chlorothionocarbonate,phenoxythiocarbonyl chloride,chlorothioformic acid phenyl ester,o-phenyl chlorothionoformate,o-phenyl chlorothiocarbonate
InChI Key KOSYAAIZOGNATQ-UHFFFAOYSA-N
Molecular Formula C7H5ClOS