3-(4-Morpholinyl)-3-oxopropanoic acid - CAS 105397-92-0

Catalog:	BB001638
Product Name:	3-(4-Morpholinyl)-3-oxopropanoic acid
CAS:	105397-92-0
Synonyms:	3-morpholin-4-yl-3-oxopropanoic acid

Technical Data

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Computed Properties

IUPAC Name:	3-morpholin-4-yl-3-oxopropanoic acid
Description:	3-(4-Morpholinyl)-3-oxopropanoic acid (CAS# 105397-92-0) is a useful research chemical.
Molecular Weight:	173.17
Molecular Formula:	C7H11NO4
Canonical SMILES:	C1COCCN1C(=O)CC(=O)O
InChI:	InChI=1S/C7H11NO4/c9-6(5-7(10)11)8-1-3-12-4-2-8/h1-5H2,(H,10,11)
InChI Key:	LVGHBHBZMHIHNU-UHFFFAOYSA-N
Boiling Point:	412.3 °C at 760 mmHg
MDL:	MFCD06208048
LogP:	-0.74220

Publication Number	Title	Priority Date
EP-3083586-A1	Novel carboxamides, method for the production thereof, pharmaceutical preparations comprising them, and use thereof for producing medicaments	20131219
WO-2015091426-A1	Novel carboxamides, method for the production thereof, pharmaceutical preparations comprising them, and use thereof for producing medicaments	20131219
EP-2829539-A1	New pyrrole derivatives, method of preparing same and pharmaceutical compositions containing them	20130723
EP-2829539-B1	New pyrrole derivatives, method of preparing same and pharmaceutical compositions containing them	20130723
EP-2829545-A1	New phosphate derivatives, method of preparing same and pharmaceutical compositions containing them	20130723

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Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	173.06880783
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	173.06880783
Rotatable Bond Count:	2
Topological Polar Surface Area:	66.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1