2-Cyclopropyl-2-oxoacetic Acid - CAS 13885-13-7

Catalog:	BB008853
Product Name:	2-Cyclopropyl-2-oxoacetic Acid
CAS:	13885-13-7
Synonyms:	2-cyclopropyl-2-oxoacetic acid; 2-cyclopropyl-2-oxoacetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-cyclopropyl-2-oxoacetic acid
Description:	2-Cyclopropyl-2-oxoacetic Acid (CAS# 13885-13-7) is a useful research chemical.
Molecular Weight:	114.10
Molecular Formula:	C5H6O3
Canonical SMILES:	C1CC1C(=O)C(=O)O
InChI:	InChI=1S/C5H6O3/c6-4(5(7)8)3-1-2-3/h3H,1-2H2,(H,7,8)
InChI Key:	LCSYJVAKMPOJIB-UHFFFAOYSA-N
Appearance:	Liquid
LogP:	0.05010

Publication Number	Title	Priority Date
CN-113045543-A	PRMT5 inhibitor and application thereof	20191226
US-2021289794-A1	Compositions and related methods for agriculture	20180725
CN-110386939-A	The solvate crystals and preparation method thereof of PARP inhibitor	20180419
WO-2018192576-A1	Method for preparing parp inhibitor compound, and intermediate, amorphous form, solvate, pharmaceutical composition, and application thereof	20170421
TW-201619162-A	Substituted 5-methyl-[1,2,4]triazolo[1,5-A]pyrimidin-2-amine compound as PDE2 inhibitor	20141105

PMID	Publication Date	Title	Journal
21793579	20110831	Cyclopropylhydroxycarbene	Journal of the American Chemical Society

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Related Functional Groups

Carbonyl Compounds

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2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

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Complexity:	135
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	114.031694049
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	114.031694049
Rotatable Bond Count:	2
Topological Polar Surface Area:	54.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1