Methyl 3-Morpholinecarboxylate - CAS 126264-49-1

Catalog:	BB006545
Product Name:	Methyl 3-Morpholinecarboxylate
CAS:	126264-49-1
Synonyms:	3-morpholinecarboxylic acid methyl ester; methyl morpholine-3-carboxylate

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Computed Properties

IUPAC Name:	methyl morpholine-3-carboxylate
Description:	Methyl 3-Morpholinecarboxylate (CAS# 126264-49-1) is a useful research chemical.
Molecular Weight:	145.16
Molecular Formula:	C6H11NO3
Canonical SMILES:	COC(=O)C1COCCN1
InChI:	InChI=1S/C6H11NO3/c1-9-6(8)5-4-10-3-2-7-5/h5,7H,2-4H2,1H3
InChI Key:	VVYXIRKYWOEDRA-UHFFFAOYSA-N
Boiling Point:	202.2 °C at 760 mmHg
Density:	1.106 g/cm³
Appearance:	Liquid
LogP:	-0.52340

Publication Number	Title	Priority Date
WO-2020228649-A1	Substituted phenylpropenylpyridine derivative, and preparation method therefor and medical use thereof	20190510
CN-112566905-A	Substituted phenyl propenyl pyridine derivatives, preparation method and medical application thereof	20190510
WO-2020182990-A1	Fused ring pyrimidone derivatives for use in the treatment of hbv infection or of hbv-induced diseases	20190314
TW-202100524-A	Fused ring pyrimidone derivatives for use in the treatment of hbv infection or of hbv-induced diseases	20190314
WO-2020156505-A1	2-amionpyrimidine derivative, preparation method therefor and application thereof in medicines	20190202

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Complexity:	126
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	145.07389321
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	145.07389321
Rotatable Bond Count:	2
Topological Polar Surface Area:	47.6
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6