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Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate

Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate - CAS 359424-42-3

Name: Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB022806
Product Name:	Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate
CAS:	359424-42-3
Synonyms:	3-(3,5-difluorophenyl)-3-oxopropanoic acid ethyl ester; ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate
Description:	Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate (CAS# 359424-42-3 ) is a useful research chemical.
Molecular Weight:	228.19
Molecular Formula:	C11H10F2O3
Canonical SMILES:	CCOC(=O)CC(=O)C1=CC(=CC(=C1)F)F
InChI:	InChI=1S/C11H10F2O3/c1-2-16-11(15)6-10(14)7-3-8(12)5-9(13)4-7/h3-5H,2,6H2,1H3
InChI Key:	SJQAWRHMPXRCRM-UHFFFAOYSA-N
MDL:	MFCD07783525
LogP:	2.10070

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Publication Number	Title	Priority Date
EP-2617723-A2	Novel compound acting as a cannabinoid receptor-1 inhibitor	20100831
JP-2013536836-A	Novel compounds as cannabinoid 1 receptor inhibitors	20100831
JP-5859544-B2	Novel compounds as cannabinoid 1 receptor inhibitors	20100831
KR-101914161-B1	Novel compound acting as a cannabinoid receptor-1 inhibitor	20100831
KR-20130099930-A	Novel compounds act as cannabinoid 1 receptor inhibitors	20100831

Complexity:	258
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	228.0598005
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	228.0598005
Rotatable Bond Count:	5
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1