(S)-3-(Cbz-amino)-2-pyrrolidinone - CAS 118507-50-9

Catalog:	BB004124
Product Name:	(S)-3-(Cbz-amino)-2-pyrrolidinone
CAS:	118507-50-9
Synonyms:	N-[(3S)-2-oxo-3-pyrrolidinyl]carbamic acid (phenylmethyl) ester; benzyl N-[(3S)-2-oxopyrrolidin-3-yl]carbamate

Technical Data

Patents

Computed Properties

IUPAC Name:	benzyl N-[(3S)-2-oxopyrrolidin-3-yl]carbamate
Description:	(S)-3-(Cbz-amino)-2-pyrrolidinone (CAS# 118507-50-9 ) is a useful research chemical.
Molecular Weight:	234.25
Molecular Formula:	C12H14N2O3
Canonical SMILES:	C1CNC(=O)C1NC(=O)OCC2=CC=CC=C2
InChI:	InChI=1S/C12H14N2O3/c15-11-10(6-7-13-11)14-12(16)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,15)(H,14,16)/t10-/m0/s1
InChI Key:	DAMJCWMGELCIMI-JTQLQIEISA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.28160

Publication Number	Title	Priority Date
AU-2012357123-A1	Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application	20111221
AU-2012357123-B2	Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application	20111221
CA-2859575-A1	Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application	20111221
CN-104136030-A	Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application	20111221
EP-2606893-A1	Sulphonylaminopyrrolidinone derivatives, their preparation and their therapeutic application	20111221

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Complexity:	288
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	234.10044231
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	234.10044231
Rotatable Bond Count:	4
Topological Polar Surface Area:	67.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9