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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 (129,837)
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 (281)
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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2,371 – 2,385 of 158,358 results
2,371
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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
2,372
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(1S,2S)-(+)-2-Benzyloxycyclohexyl isothiocyanate, 97%

CAS: 737000-89-4 Molecular Formula: C14H17NOS Molecular Weight (g/mol): 247.356 MDL Number: MFCD05664047 InChI Key: DNRPSBSMXLYTQF-KBPBESRZSA-N Synonym: 1s,2s-+-2-benzyloxycyclohexyl isothiocyanate,1s,2s-2-isothiocyanatocyclohexyl oxy methyl benzene,1s,2s-2-phenylmethoxy cyclohexanisothiocyanate PubChem CID: 11863573 IUPAC Name: [(1S,2S)-2-isothiocyanatocyclohexyl]oxymethylbenzene SMILES: C1CCC(C(C1)N=C=S)OCC2=CC=CC=C2

PubChem CID 11863573
CAS 737000-89-4
Molecular Weight (g/mol) 247.356
MDL Number MFCD05664047
SMILES C1CCC(C(C1)N=C=S)OCC2=CC=CC=C2
Synonym 1s,2s-+-2-benzyloxycyclohexyl isothiocyanate,1s,2s-2-isothiocyanatocyclohexyl oxy methyl benzene,1s,2s-2-phenylmethoxy cyclohexanisothiocyanate
IUPAC Name [(1S,2S)-2-isothiocyanatocyclohexyl]oxymethylbenzene
InChI Key DNRPSBSMXLYTQF-KBPBESRZSA-N
Molecular Formula C14H17NOS
2,373
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2-(Trifluoromethyl)phenylglyoxal hydrate, 98%, dry wt. basis

CAS: 745783-91-9 Molecular Formula: C9H5F3O2 Molecular Weight (g/mol): 202.13 MDL Number: MFCD08533288 InChI Key: HBOSPPHIPGYHDI-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenylglyoxal hydrate,2-oxo-2-2-trifluoromethyl phenyl acetaldehyde hydrate,2-oxo-2-2-trifluoromethyl phenyl ethanal, oxamethane,benzeneacetaldehyde, a-oxo-2-trifluoromethyl-,hydrate 1:1 PubChem CID: 2783281 IUPAC Name: 2-oxo-2-[2-(trifluoromethyl)phenyl]acetaldehyde;hydrate SMILES: FC(F)(F)C1=CC=CC=C1C(=O)C=O

PubChem CID 2783281
CAS 745783-91-9
Molecular Weight (g/mol) 202.13
MDL Number MFCD08533288
SMILES FC(F)(F)C1=CC=CC=C1C(=O)C=O
Synonym 2-trifluoromethyl phenylglyoxal hydrate,2-oxo-2-2-trifluoromethyl phenyl acetaldehyde hydrate,2-oxo-2-2-trifluoromethyl phenyl ethanal, oxamethane,benzeneacetaldehyde, a-oxo-2-trifluoromethyl-,hydrate 1:1
IUPAC Name 2-oxo-2-[2-(trifluoromethyl)phenyl]acetaldehyde;hydrate
InChI Key HBOSPPHIPGYHDI-UHFFFAOYSA-N
Molecular Formula C9H5F3O2
2,374
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2,6-Di-tert-butylphenol, 99%

CAS: 128-39-2 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.33 MDL Number: MFCD00008820 InChI Key: DKCPKDPYUFEZCP-UHFFFAOYSA-N Synonym: 2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701 PubChem CID: 31405 IUPAC Name: 2,6-ditert-butylphenol SMILES: CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C

PubChem CID 31405
CAS 128-39-2
Molecular Weight (g/mol) 206.33
MDL Number MFCD00008820
SMILES CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C
Synonym 2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701
IUPAC Name 2,6-ditert-butylphenol
InChI Key DKCPKDPYUFEZCP-UHFFFAOYSA-N
Molecular Formula C14H22O
2,375
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4-Bromobenzyl chloride, 97%

CAS: 589-17-3 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.48 MDL Number: MFCD00040867 InChI Key: BSIIGUGKOPPTPZ-UHFFFAOYSA-N Synonym: 1-bromo-4-chloromethyl benzene,4-bromobenzyl chloride,p-bromobenzyl chloride,4-bromobenzylchloride,4-bromo-alpha-chlorotoluene,benzene, 1-bromo-4-chloromethyl,ccris 5105,p-bromo-alpha-chlorotoluene,pubchem2478,4-bromo-benzylchloride PubChem CID: 68528 IUPAC Name: 1-bromo-4-(chloromethyl)benzene SMILES: ClCC1=CC=C(Br)C=C1

PubChem CID 68528
CAS 589-17-3
Molecular Weight (g/mol) 205.48
MDL Number MFCD00040867
SMILES ClCC1=CC=C(Br)C=C1
Synonym 1-bromo-4-chloromethyl benzene,4-bromobenzyl chloride,p-bromobenzyl chloride,4-bromobenzylchloride,4-bromo-alpha-chlorotoluene,benzene, 1-bromo-4-chloromethyl,ccris 5105,p-bromo-alpha-chlorotoluene,pubchem2478,4-bromo-benzylchloride
IUPAC Name 1-bromo-4-(chloromethyl)benzene
InChI Key BSIIGUGKOPPTPZ-UHFFFAOYSA-N
Molecular Formula C7H6BrCl
2,376
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4-Iodo-3-nitroanisole, 98+%

CAS: 58755-70-7 Molecular Formula: C7H6INO3 Molecular Weight (g/mol): 279.033 MDL Number: MFCD00024195 InChI Key: JWZODIRSJJQOKY-UHFFFAOYSA-N Synonym: 4-iodo-3-nitroanisole,3-nitro-4-iodoanisole,2-iodo-5-methoxynitrobenzene,1-iodo-4-methoxy-2-nitro-benzene,benzene, 1-iodo-4-methoxy-2-nitro,3-nitro-4-iodoanisol,acmc-1b13g,ksc494s9p,1-iodo-2-nitro-4-methoxybenzene,attercop-chm at115569 PubChem CID: 292659 IUPAC Name: 1-iodo-4-methoxy-2-nitrobenzene SMILES: COC1=CC(=C(C=C1)I)[N+](=O)[O-]

PubChem CID 292659
CAS 58755-70-7
Molecular Weight (g/mol) 279.033
MDL Number MFCD00024195
SMILES COC1=CC(=C(C=C1)I)[N+](=O)[O-]
Synonym 4-iodo-3-nitroanisole,3-nitro-4-iodoanisole,2-iodo-5-methoxynitrobenzene,1-iodo-4-methoxy-2-nitro-benzene,benzene, 1-iodo-4-methoxy-2-nitro,3-nitro-4-iodoanisol,acmc-1b13g,ksc494s9p,1-iodo-2-nitro-4-methoxybenzene,attercop-chm at115569
IUPAC Name 1-iodo-4-methoxy-2-nitrobenzene
InChI Key JWZODIRSJJQOKY-UHFFFAOYSA-N
Molecular Formula C7H6INO3
2,377
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(R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%

CAS: 39637-99-5 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride PubChem CID: 3080792 IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

PubChem CID 3080792
CAS 39637-99-5
Molecular Weight (g/mol) 252.62
MDL Number MFCD00044400
SMILES CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride
IUPAC Name (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula C10H8ClF3O2
2,378

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
2,379
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3,5-Dimethylbenzyl alcohol, 99%

CAS: 27129-87-9 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00004648 InChI Key: IQWWTJDRVBWBEL-UHFFFAOYSA-N PubChem CID: 33706 IUPAC Name: (3,5-dimethylphenyl)methanol SMILES: CC1=CC(=CC(=C1)CO)C

PubChem CID 33706
CAS 27129-87-9
Molecular Weight (g/mol) 136.194
MDL Number MFCD00004648
SMILES CC1=CC(=CC(=C1)CO)C
IUPAC Name (3,5-dimethylphenyl)methanol
InChI Key IQWWTJDRVBWBEL-UHFFFAOYSA-N
Molecular Formula C9H12O
2,380
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2-Chloro-4-(trifluoromethyl)benzeneboronic acid, 96%

CAS: 254993-59-4 Molecular Formula: C7H5BClF3O2 Molecular Weight (g/mol): 224.37 MDL Number: MFCD02684337 InChI Key: JKSUCAFAUNSPLO-UHFFFAOYSA-N Synonym: 2-chloro-4-trifluoromethyl phenylboronic acid,2-chloro-4-trifluoromethylphenylboronic acid,2-chloro-4-trifluoromethyl benzeneboronic acid,2-chloro-4-trifluoromethyl phenyl boronic acid,2-chloro-4-trifluoromethyl phenylboronicacid,2-chloro-4-trifluoromethylphenyl boronic acid,boronic acid, 2-chloro-4-trifluoromethyl phenyl,2-fluoro-4-iodophenylboronicacid PubChem CID: 2783251 IUPAC Name: [2-chloro-4-(trifluoromethyl)phenyl]boronic acid SMILES: OB(O)C1=C(Cl)C=C(C=C1)C(F)(F)F

PubChem CID 2783251
CAS 254993-59-4
Molecular Weight (g/mol) 224.37
MDL Number MFCD02684337
SMILES OB(O)C1=C(Cl)C=C(C=C1)C(F)(F)F
Synonym 2-chloro-4-trifluoromethyl phenylboronic acid,2-chloro-4-trifluoromethylphenylboronic acid,2-chloro-4-trifluoromethyl benzeneboronic acid,2-chloro-4-trifluoromethyl phenyl boronic acid,2-chloro-4-trifluoromethyl phenylboronicacid,2-chloro-4-trifluoromethylphenyl boronic acid,boronic acid, 2-chloro-4-trifluoromethyl phenyl,2-fluoro-4-iodophenylboronicacid
IUPAC Name [2-chloro-4-(trifluoromethyl)phenyl]boronic acid
InChI Key JKSUCAFAUNSPLO-UHFFFAOYSA-N
Molecular Formula C7H5BClF3O2
2,381
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4-Fluorophenylglyoxal hydrate, 98%, dry wt. basis

CAS: 403-32-7 Molecular Formula: C8H5FO2 Molecular Weight (g/mol): 152.12 MDL Number: MFCD01733156 InChI Key: IPWSCROFORAGJW-UHFFFAOYSA-N Synonym: 2-4-fluorophenyl-2-oxoacetaldehyde,4-fluorophenylglyoxal,benzeneacetaldehyde, 4-fluoro-alpha-oxo,4-fluoro-phenyl-oxo-acetaldehyde,4-fluoro-alpha-oxobenzeneacetaldehyde,4-fluorophenyl oxo acetaldehyde,p-fluorophenylglyoxal,p-fluorophenyl glyoxal,4-fluorophenyl glyoxal,1-4-fluorophenyl glyoxal PubChem CID: 101249 IUPAC Name: 2-(4-fluorophenyl)-2-oxoacetaldehyde SMILES: FC1=CC=C(C=C1)C(=O)C=O

PubChem CID 101249
CAS 403-32-7
Molecular Weight (g/mol) 152.12
MDL Number MFCD01733156
SMILES FC1=CC=C(C=C1)C(=O)C=O
Synonym 2-4-fluorophenyl-2-oxoacetaldehyde,4-fluorophenylglyoxal,benzeneacetaldehyde, 4-fluoro-alpha-oxo,4-fluoro-phenyl-oxo-acetaldehyde,4-fluoro-alpha-oxobenzeneacetaldehyde,4-fluorophenyl oxo acetaldehyde,p-fluorophenylglyoxal,p-fluorophenyl glyoxal,4-fluorophenyl glyoxal,1-4-fluorophenyl glyoxal
IUPAC Name 2-(4-fluorophenyl)-2-oxoacetaldehyde
InChI Key IPWSCROFORAGJW-UHFFFAOYSA-N
Molecular Formula C8H5FO2
2,382
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3-Methoxyphenylglyoxal hydrate, 97%, dry wt. basis, Thermo Scientific Chemicals

CAS: 32025-65-3 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD08533286 InChI Key: SIHYQEYAJMDKQH-UHFFFAOYSA-N Synonym: 3-methoxyphenylglyoxal hydrate,2-3-methoxyphenyl-2-oxoacetaldehyde hydrate,acmc-1c24s,bestipharma 555-843,3-methoxyphenylglyoxal monohydrate,ethanone,2,2-dihydroxy-1-3-methylphenyl,3-methoxyphenyl oxo acetaldehyde-water 1/1,2-3-methoxyphenyl-2-oxidanylidene-ethanal hydrate PubChem CID: 21155397 IUPAC Name: 2-(3-methoxyphenyl)-2-oxoacetaldehyde;hydrate SMILES: COC1=CC=CC(=C1)C(=O)C=O

PubChem CID 21155397
CAS 32025-65-3
Molecular Weight (g/mol) 164.16
MDL Number MFCD08533286
SMILES COC1=CC=CC(=C1)C(=O)C=O
Synonym 3-methoxyphenylglyoxal hydrate,2-3-methoxyphenyl-2-oxoacetaldehyde hydrate,acmc-1c24s,bestipharma 555-843,3-methoxyphenylglyoxal monohydrate,ethanone,2,2-dihydroxy-1-3-methylphenyl,3-methoxyphenyl oxo acetaldehyde-water 1/1,2-3-methoxyphenyl-2-oxidanylidene-ethanal hydrate
IUPAC Name 2-(3-methoxyphenyl)-2-oxoacetaldehyde;hydrate
InChI Key SIHYQEYAJMDKQH-UHFFFAOYSA-N
Molecular Formula C9H8O3
2,383
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2-(Methylthio)phenol, 97+%

CAS: 1073-29-6 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00002211 InChI Key: SOOARYARZPXNAL-UHFFFAOYSA-N Synonym: 2-methylthio phenol,2-hydroxythioanisole,2-methylsulfanyl phenol,2-hydroxy thioanisole,phenol, 2-methylthio,o-hydroxythioanisole,o-methylthio phenol,phenol, o-methylthio,2-methylmercaptophenol,2-methylmercapto phenol PubChem CID: 61261 IUPAC Name: 2-methylsulfanylphenol SMILES: CSC1=CC=CC=C1O

PubChem CID 61261
CAS 1073-29-6
Molecular Weight (g/mol) 140.20
MDL Number MFCD00002211
SMILES CSC1=CC=CC=C1O
Synonym 2-methylthio phenol,2-hydroxythioanisole,2-methylsulfanyl phenol,2-hydroxy thioanisole,phenol, 2-methylthio,o-hydroxythioanisole,o-methylthio phenol,phenol, o-methylthio,2-methylmercaptophenol,2-methylmercapto phenol
IUPAC Name 2-methylsulfanylphenol
InChI Key SOOARYARZPXNAL-UHFFFAOYSA-N
Molecular Formula C7H8OS
2,384
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4-Methyl-3-nitrobenzaldehyde, 98%

CAS: 31680-07-6 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00017011 InChI Key: KHWGAWBXQOKXIJ-UHFFFAOYSA-N Synonym: 3-nitro-p-tolualdehyde,4-methyl-3-nitro-benzaldehyde,3-nitro-4-methylbenzaldehyde,benzaldehyde, 4-methyl-3-nitro,methylnitrobenzaldehyde,pubchem8157,acmc-209hod,4-methyl-3-nitrobenzaldehyde PubChem CID: 1798998 IUPAC Name: 4-methyl-3-nitrobenzaldehyde SMILES: CC1=CC=C(C=O)C=C1[N+]([O-])=O

PubChem CID 1798998
CAS 31680-07-6
Molecular Weight (g/mol) 165.15
MDL Number MFCD00017011
SMILES CC1=CC=C(C=O)C=C1[N+]([O-])=O
Synonym 3-nitro-p-tolualdehyde,4-methyl-3-nitro-benzaldehyde,3-nitro-4-methylbenzaldehyde,benzaldehyde, 4-methyl-3-nitro,methylnitrobenzaldehyde,pubchem8157,acmc-209hod,4-methyl-3-nitrobenzaldehyde
IUPAC Name 4-methyl-3-nitrobenzaldehyde
InChI Key KHWGAWBXQOKXIJ-UHFFFAOYSA-N
Molecular Formula C8H7NO3
2,385
Promotions Available

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