Methyl 3-(4-Nitrophenyl)-3-oxopropionate - CAS 59156-55-7

Catalog:	BB030291
Product Name:	Methyl 3-(4-Nitrophenyl)-3-oxopropionate
CAS:	59156-55-7
Synonyms:	3-(4-nitrophenyl)-3-oxopropanoic acid methyl ester; methyl 3-(4-nitrophenyl)-3-oxopropanoate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 3-(4-nitrophenyl)-3-oxopropanoate
Description:	Methyl 3-(4-Nitrophenyl)-3-oxopropionate (CAS# 59156-55-7 ) is a useful research chemical.
Molecular Weight:	223.18
Molecular Formula:	C10H9NO5
Canonical SMILES:	COC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
InChI:	InChI=1S/C10H9NO5/c1-16-10(13)6-9(12)7-2-4-8(5-3-7)11(14)15/h2-5H,6H2,1H3
InChI Key:	MWPJNFPGFILHOY-UHFFFAOYSA-N
LogP:	0.68970

Publication Number	Title	Priority Date
CN-108329291-B	Synthesis method of ionic liquid catalyzed 9-anthrone lactone compound	20180131
US-2007053831-A1	Methods for binding agents to b-amyloid plaques	20030520
US-4829076-A	Novel dihydropyridines having calcium antagonistic and antihypertensive activity	19860916
US-4176918-A	Fluorescent liquid crystal display	19771114
CH-632780-A5	Process for the preparation of a basic red dye	19770414

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

Complexity:	288
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	223.04807239
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	223.04807239
Rotatable Bond Count:	4
Topological Polar Surface Area:	89.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5