Complex Ketones

Organic compounds that contain one or more ketone functional groups; a ketone functional group consists of a carbonyl with a carbon atom, or other functional group adjacent to each side.

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166 – 180 of 2,801 results

166

Methyl 4-chloroacetoacetate, 97%

CAS: 32807-28-6 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000938 InChI Key: HFLMYYLFSNEOOT-UHFFFAOYSA-N Synonym: methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042 PubChem CID: 36240 IUPAC Name: methyl 4-chloro-3-oxobutanoate SMILES: COC(=O)CC(=O)CCl

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Specifications

PubChem CID	36240
CAS	32807-28-6
Molecular Weight (g/mol)	150.56
MDL Number	MFCD00000938
SMILES	COC(=O)CC(=O)CCl
Synonym	methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042
IUPAC Name	methyl 4-chloro-3-oxobutanoate
InChI Key	HFLMYYLFSNEOOT-UHFFFAOYSA-N
Molecular Formula	C5H7ClO3

167

2',4'-Difluoroacetophenone, 99%

CAS: 364-83-0 Molecular Formula: C₈H₆F₂O Molecular Weight (g/mol): 156.12 MDL Number: MFCD00151261 InChI Key: QEWHNJPLPZOEKU-UHFFFAOYSA-N Synonym: 2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213 PubChem CID: 67770 IUPAC Name: 1-(2,4-difluorophenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)F)F

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Specifications

PubChem CID	67770
CAS	364-83-0
Molecular Weight (g/mol)	156.12
MDL Number	MFCD00151261
SMILES	CC(=O)C1=C(C=C(C=C1)F)F
Synonym	2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213
IUPAC Name	1-(2,4-difluorophenyl)ethanone
InChI Key	QEWHNJPLPZOEKU-UHFFFAOYSA-N
Molecular Formula	C₈H₆F₂O

168

Methyl 3,3,3-trifluoropyruvate, 97%

CAS: 13089-11-7 Molecular Formula: C₄H₃F₃O₃ Molecular Weight (g/mol): 156.06 MDL Number: MFCD00114936 InChI Key: XGLLQDIWQRQROJ-UHFFFAOYSA-N Synonym: methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j PubChem CID: 2734931 IUPAC Name: methyl 3,3,3-trifluoro-2-oxopropanoate SMILES: COC(=O)C(=O)C(F)(F)F

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Specifications

PubChem CID	2734931
CAS	13089-11-7
Molecular Weight (g/mol)	156.06
MDL Number	MFCD00114936
SMILES	COC(=O)C(=O)C(F)(F)F
Synonym	methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j
IUPAC Name	methyl 3,3,3-trifluoro-2-oxopropanoate
InChI Key	XGLLQDIWQRQROJ-UHFFFAOYSA-N
Molecular Formula	C₄H₃F₃O₃

169

2'-Hydroxy-4'-methoxyacetophenone, 99%

CAS: 552-41-0 MDL Number: MFCD00008730 InChI Key: UILPJVPSNHJFIK-UHFFFAOYSA-N Synonym: paeonol,2'-hydroxy-4'-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethanone,peonol,2-hydroxy-4-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethan-1-one,resacetophenone-4-methyl ether,ethanone, 1-2-hydroxy-4-methoxyphenyl,paeonal,paeonolum PubChem CID: 11092 ChEBI: CHEBI:69581 IUPAC Name: 1-(2-hydroxy-4-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)OC)O

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Specifications

PubChem CID	11092
CAS	552-41-0
ChEBI	CHEBI:69581
MDL Number	MFCD00008730
SMILES	CC(=O)C1=C(C=C(C=C1)OC)O
Synonym	paeonol,2'-hydroxy-4'-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethanone,peonol,2-hydroxy-4-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethan-1-one,resacetophenone-4-methyl ether,ethanone, 1-2-hydroxy-4-methoxyphenyl,paeonal,paeonolum
IUPAC Name	1-(2-hydroxy-4-methoxyphenyl)ethanone
InChI Key	UILPJVPSNHJFIK-UHFFFAOYSA-N

170

2',6'-Difluoroacetophenone, 98%

CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 PubChem CID: 83643 SMILES: CC(=O)C1=C(F)C=CC=C1F

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Specifications

PubChem CID	83643
CAS	13670-99-0
Molecular Weight (g/mol)	156.13
MDL Number	MFCD00000328
SMILES	CC(=O)C1=C(F)C=CC=C1F
Synonym	2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054
InChI Key	VGIIILXIQLXVLC-UHFFFAOYSA-N
Molecular Formula	C8H6F2O

171

p-Toluoylacetonitrile, 97%

CAS: 7391-28-8 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00067895 InChI Key: AIECDYDQPCANJK-UHFFFAOYSA-N Synonym: 4-methylbenzoylacetonitrile,4-toluoylacetonitrile,3-4-methylphenyl-3-oxopropanenitrile,p-toluoylacetonitrile,3-oxo-3-p-tolyl propanenitrile,3-oxo-3-p-tolylpropanenitrile,acmc-20amdj,pubchem12072,maybridge1_004714,4-methyl-benzoylacetonitrile PubChem CID: 522513 IUPAC Name: 3-(4-methylphenyl)-3-oxopropanenitrile SMILES: CC1=CC=C(C=C1)C(=O)CC#N

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Specifications

PubChem CID	522513
CAS	7391-28-8
Molecular Weight (g/mol)	159.19
MDL Number	MFCD00067895
SMILES	CC1=CC=C(C=C1)C(=O)CC#N
Synonym	4-methylbenzoylacetonitrile,4-toluoylacetonitrile,3-4-methylphenyl-3-oxopropanenitrile,p-toluoylacetonitrile,3-oxo-3-p-tolyl propanenitrile,3-oxo-3-p-tolylpropanenitrile,acmc-20amdj,pubchem12072,maybridge1_004714,4-methyl-benzoylacetonitrile
IUPAC Name	3-(4-methylphenyl)-3-oxopropanenitrile
InChI Key	AIECDYDQPCANJK-UHFFFAOYSA-N
Molecular Formula	C10H9NO

172

4'-Bromoacetophenone, 98%

CAS: 99-90-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.05 MDL Number: MFCD00000105 InChI Key: WYECURVXVYPVAT-UHFFFAOYSA-N Synonym: 4'-bromoacetophenone,1-4-bromophenyl ethanone,p-bromoacetophenone,4-bromoacetophenone,ethanone, 1-4-bromophenyl,1-4-bromophenyl ethan-1-one,1-acetyl-4-bromobenzene,methyl p-bromophenyl ketone,p-bromophenyl methyl ketone,acetophenone, 4'-bromo PubChem CID: 7466 IUPAC Name: 1-(4-bromophenyl)ethanone SMILES: CC(=O)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	7466
CAS	99-90-1
Molecular Weight (g/mol)	199.05
MDL Number	MFCD00000105
SMILES	CC(=O)C1=CC=C(Br)C=C1
Synonym	4'-bromoacetophenone,1-4-bromophenyl ethanone,p-bromoacetophenone,4-bromoacetophenone,ethanone, 1-4-bromophenyl,1-4-bromophenyl ethan-1-one,1-acetyl-4-bromobenzene,methyl p-bromophenyl ketone,p-bromophenyl methyl ketone,acetophenone, 4'-bromo
IUPAC Name	1-(4-bromophenyl)ethanone
InChI Key	WYECURVXVYPVAT-UHFFFAOYSA-N
Molecular Formula	C8H7BrO

173

2-(2-Nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione, 95%

CAS: 104206-65-7 Molecular Formula: C14H10F3NO5 Molecular Weight (g/mol): 329.231 MDL Number: MFCD01752192 InChI Key: OUBCNLGXQFSTLU-UHFFFAOYSA-N Synonym: nitisinone,orfadin,nitisone,ntbc,2-2-nitro-4-trifluoromethyl benzoyl cyclohexane-1,3-dione,2-2-nitro-4-trifluoromethylbenzoyl-1,3-cyclohexanedione,nitisinone usan:inn,nitisinone inn,nitisinona PubChem CID: 115355 ChEBI: CHEBI:50378 IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione SMILES: C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

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Specifications

PubChem CID	115355
CAS	104206-65-7
Molecular Weight (g/mol)	329.231
ChEBI	CHEBI:50378
MDL Number	MFCD01752192
SMILES	C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
Synonym	nitisinone,orfadin,nitisone,ntbc,2-2-nitro-4-trifluoromethyl benzoyl cyclohexane-1,3-dione,2-2-nitro-4-trifluoromethylbenzoyl-1,3-cyclohexanedione,nitisinone usan:inn,nitisinone inn,nitisinona
IUPAC Name	2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione
InChI Key	OUBCNLGXQFSTLU-UHFFFAOYSA-N
Molecular Formula	C14H10F3NO5

174

3'-Fluoro-4'-methoxyacetophenone, 99%

CAS: 455-91-4 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00026219 InChI Key: LQASUDVYVOFKNK-UHFFFAOYSA-N Synonym: 3'-fluoro-4'-methoxyacetophenone,3-fluoro-4-methoxyacetophenone,1-3-fluoro-4-methoxyphenyl ethanone,1-3-fluoro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-fluoro-4-methoxyphenyl,3'-fluoro-4-methoxyacetophenone,acetophenone, 3'-fluoro-4'-methoxy,1-3-fluoro-4-methoxy-phenyl-ethanone,1-3-fluoro-4-methoxyphenyl-1-ethanone,1-3-fluoro-4-methoxy-phenyl ethanone PubChem CID: 96828 IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC)F

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Specifications

PubChem CID	96828
CAS	455-91-4
Molecular Weight (g/mol)	168.167
MDL Number	MFCD00026219
SMILES	CC(=O)C1=CC(=C(C=C1)OC)F
Synonym	3'-fluoro-4'-methoxyacetophenone,3-fluoro-4-methoxyacetophenone,1-3-fluoro-4-methoxyphenyl ethanone,1-3-fluoro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-fluoro-4-methoxyphenyl,3'-fluoro-4-methoxyacetophenone,acetophenone, 3'-fluoro-4'-methoxy,1-3-fluoro-4-methoxy-phenyl-ethanone,1-3-fluoro-4-methoxyphenyl-1-ethanone,1-3-fluoro-4-methoxy-phenyl ethanone
IUPAC Name	1-(3-fluoro-4-methoxyphenyl)ethanone
InChI Key	LQASUDVYVOFKNK-UHFFFAOYSA-N
Molecular Formula	C9H9FO2

175

Ethyl 3,3,3-trifluoropyruvate, 98+%

CAS: 13081-18-0 Molecular Formula: C5H5F3O3 Molecular Weight (g/mol): 170.09 MDL Number: MFCD00114935 InChI Key: KJHQVUNUOIEYSV-UHFFFAOYSA-N Synonym: ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013 PubChem CID: 2737239 IUPAC Name: ethyl 3,3,3-trifluoro-2-oxopropanoate SMILES: CCOC(=O)C(=O)C(F)(F)F

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Specifications

PubChem CID	2737239
CAS	13081-18-0
Molecular Weight (g/mol)	170.09
MDL Number	MFCD00114935
SMILES	CCOC(=O)C(=O)C(F)(F)F
Synonym	ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013
IUPAC Name	ethyl 3,3,3-trifluoro-2-oxopropanoate
InChI Key	KJHQVUNUOIEYSV-UHFFFAOYSA-N
Molecular Formula	C5H5F3O3

176

1,8-Dichloroanthraquinone, MP Biomedicals

CAS: 82-43-9 Molecular Formula: C14H6Cl2O2 Molecular Weight (g/mol): 277.1 InChI Key: VBQNYYXVDQUKIU-UHFFFAOYSA-N Synonym: 1,8-dichloroanthraquinone,9,10-anthracenedione, 1,8-dichloro,1,8-dichloranthrachinon,1,8-dichloro-9,10-anthraquinone,anthraquinone, 1,8-dichloro,1,8-dichloranthrachinon czech,acmc-1bmbx,9, 1,8-dichloro,anthraquinone,8-dichloro PubChem CID: 6708 IUPAC Name: 1,8-dichloroanthracene-9,10-dione SMILES: C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C=CC=C3Cl

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Specifications

PubChem CID	6708
CAS	82-43-9
Molecular Weight (g/mol)	277.1
SMILES	C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C=CC=C3Cl
Synonym	1,8-dichloroanthraquinone,9,10-anthracenedione, 1,8-dichloro,1,8-dichloranthrachinon,1,8-dichloro-9,10-anthraquinone,anthraquinone, 1,8-dichloro,1,8-dichloranthrachinon czech,acmc-1bmbx,9, 1,8-dichloro,anthraquinone,8-dichloro
IUPAC Name	1,8-dichloroanthracene-9,10-dione
InChI Key	VBQNYYXVDQUKIU-UHFFFAOYSA-N
Molecular Formula	C14H6Cl2O2

177

3-(2-Bromoacetyl)benzonitrile, 95%, Thermo Scientific™

CAS: 50916-55-7 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.06 MDL Number: MFCD00833267 InChI Key: XWCGNFLHRINYCE-UHFFFAOYSA-N Synonym: 3-2-bromoacetyl benzonitrile,3-cyanophenacyl bromide,3-cyanophenacylbromide,2-bromo-3'-cyanoacetophenone,3-2-bromoacetyl benzenecarbonitrile,3-bromoacetyl benzonitrile,3-2-bromo-acetyl-benzonitrile,benzonitrile, 3-bromoacetyl,3-bromoacetyl-benzonitrile PubChem CID: 2735867 IUPAC Name: 3-(2-bromoacetyl)benzonitrile SMILES: BrCC(=O)C1=CC=CC(=C1)C#N

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Specifications

PubChem CID	2735867
CAS	50916-55-7
Molecular Weight (g/mol)	224.06
MDL Number	MFCD00833267
SMILES	BrCC(=O)C1=CC=CC(=C1)C#N
Synonym	3-2-bromoacetyl benzonitrile,3-cyanophenacyl bromide,3-cyanophenacylbromide,2-bromo-3'-cyanoacetophenone,3-2-bromoacetyl benzenecarbonitrile,3-bromoacetyl benzonitrile,3-2-bromo-acetyl-benzonitrile,benzonitrile, 3-bromoacetyl,3-bromoacetyl-benzonitrile
IUPAC Name	3-(2-bromoacetyl)benzonitrile
InChI Key	XWCGNFLHRINYCE-UHFFFAOYSA-N
Molecular Formula	C9H6BrNO

178

Methyl 4-fluorobenzoylacetate, 95%

CAS: 63131-29-3 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00000355 InChI Key: HGLVYXXPRSNKQN-UHFFFAOYSA-N Synonym: methyl 4-fluorobenzoylacetate,methyl 3-4-fluorophenyl-3-oxopropanoate,methyl p-fluorobenzoylacetate,4-fluorobenzoylacetic acid methyl ester,methyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester,benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester,benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester,pubchem16721,acmc-209nd6 PubChem CID: 579425 IUPAC Name: methyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)F

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Specifications

PubChem CID	579425
CAS	63131-29-3
Molecular Weight (g/mol)	196.177
MDL Number	MFCD00000355
SMILES	COC(=O)CC(=O)C1=CC=C(C=C1)F
Synonym	methyl 4-fluorobenzoylacetate,methyl 3-4-fluorophenyl-3-oxopropanoate,methyl p-fluorobenzoylacetate,4-fluorobenzoylacetic acid methyl ester,methyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester,benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester,benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester,pubchem16721,acmc-209nd6
IUPAC Name	methyl 3-(4-fluorophenyl)-3-oxopropanoate
InChI Key	HGLVYXXPRSNKQN-UHFFFAOYSA-N
Molecular Formula	C10H9FO3

179

Desoxyanisoin, 98%

CAS: 120-44-5 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD00008406 InChI Key: SICBLYCPRWNHHP-UHFFFAOYSA-N Synonym: desoxyanisoin,deoxyanisoin,1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxydeoxybenzoin,deoxy-p-anisoin,deoxy-4-anisoin,1,2-bis 4-methoxyphenyl ethan-1-one,ethanone, 1,2-bis 4-methoxyphenyl,4-methoxybenzyl 4-methoxyphenyl ketone,acetophenone, 4'-methoxy-2-p-methoxyphenyl PubChem CID: 67120 IUPAC Name: 1,2-bis(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)OC

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Specifications

PubChem CID	67120
CAS	120-44-5
Molecular Weight (g/mol)	256.301
MDL Number	MFCD00008406
SMILES	COC1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)OC
Synonym	desoxyanisoin,deoxyanisoin,1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxydeoxybenzoin,deoxy-p-anisoin,deoxy-4-anisoin,1,2-bis 4-methoxyphenyl ethan-1-one,ethanone, 1,2-bis 4-methoxyphenyl,4-methoxybenzyl 4-methoxyphenyl ketone,acetophenone, 4'-methoxy-2-p-methoxyphenyl
IUPAC Name	1,2-bis(4-methoxyphenyl)ethanone
InChI Key	SICBLYCPRWNHHP-UHFFFAOYSA-N
Molecular Formula	C16H16O3

180

2'-Hydroxy-4',6'-dimethoxyacetophenone, 98%

CAS: 90-24-4 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00017243 InChI Key: FBUBVLUPUDBFME-UHFFFAOYSA-N Synonym: xanthoxylin,2'-hydroxy-4',6'-dimethoxyacetophenone,brevifolin,xanthoxyline,2-hydroxy-4,6-dimethoxyacetophenone,1-2-hydroxy-4,6-dimethoxyphenyl ethanone,brevifolin zanthoxylum,phloracetophenone dimethyl ether,brevifolin van,1-2-hydroxy-4,6-dimethoxyphenyl ethan-1-one PubChem CID: 66654 ChEBI: CHEBI:10070 IUPAC Name: 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone SMILES: COC1=CC(O)=C(C(C)=O)C(OC)=C1

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Specifications

PubChem CID	66654
CAS	90-24-4
Molecular Weight (g/mol)	196.20
ChEBI	CHEBI:10070
MDL Number	MFCD00017243
SMILES	COC1=CC(O)=C(C(C)=O)C(OC)=C1
Synonym	xanthoxylin,2'-hydroxy-4',6'-dimethoxyacetophenone,brevifolin,xanthoxyline,2-hydroxy-4,6-dimethoxyacetophenone,1-2-hydroxy-4,6-dimethoxyphenyl ethanone,brevifolin zanthoxylum,phloracetophenone dimethyl ether,brevifolin van,1-2-hydroxy-4,6-dimethoxyphenyl ethan-1-one
IUPAC Name	1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone
InChI Key	FBUBVLUPUDBFME-UHFFFAOYSA-N
Molecular Formula	C10H12O4

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