Methyl 2-Oxooxazolidine-5-carboxylate - CAS 15042-69-0

Catalog:	BB010537
Product Name:	Methyl 2-Oxooxazolidine-5-carboxylate
CAS:	15042-69-0
Synonyms:	2-oxo-5-oxazolidinecarboxylic acid methyl ester; methyl 2-oxo-1,3-oxazolidine-5-carboxylate

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Computed Properties

IUPAC Name:	methyl 2-oxo-1,3-oxazolidine-5-carboxylate
Description:	Methyl 2-Oxooxazolidine-5-carboxylate (CAS# 15042-69-0) is a useful research chemical.
Molecular Weight:	145.11
Molecular Formula:	C5H7NO4
Canonical SMILES:	COC(=O)C1CNC(=O)O1
InChI:	InChI=1S/C5H7NO4/c1-9-4(7)3-2-6-5(8)10-3/h3H,2H2,1H3,(H,6,8)
InChI Key:	YOAIRDDVWDKCTO-UHFFFAOYSA-N
LogP:	-0.40340

Publication Number	Title	Priority Date
CN-107949562-B	Positive allosteric modulators of muscarinic M2 receptors	20150609
JP-2009500389-A	Oxazolidinone carboxamides containing azetidine and cyclobutane as antibacterial agents	20050706
US-2009030195-A1	1-(2h)-isoquinolone derivative	20050222
US-7820693-B2	1-(2H)-isoquinolone derivative	20050222
AU-2005270951-A1	Oxazolidinones containing oxindoles as antibacterial agents	20040806

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Related Functional Groups

Carbonyl Compounds

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[832741-29-4]
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[91552-11-3]
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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	145.03750770
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	145.03750770
Rotatable Bond Count:	2
Topological Polar Surface Area:	64.6 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3