(S)-1-Boc-4-hydroxy-2-pyrrolidinone - CAS 320343-58-6

Catalog:	BB021132
Product Name:	(S)-1-Boc-4-hydroxy-2-pyrrolidinone
CAS:	320343-58-6
Synonyms:	(4S)-4-hydroxy-2-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl (4S)-4-hydroxy-2-oxopyrrolidine-1-carboxylate

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Computed Properties

IUPAC Name:	tert-butyl (4S)-4-hydroxy-2-oxopyrrolidine-1-carboxylate
Description:	(S)-1-Boc-4-hydroxy-2-pyrrolidinone (CAS# 320343-58-6 ) is a useful research chemical.
Molecular Weight:	201.22
Molecular Formula:	C9H15NO4
Canonical SMILES:	CC(C)(C)OC(=O)N1CC(CC1=O)O
InChI:	InChI=1S/C9H15NO4/c1-9(2,3)14-8(13)10-5-6(11)4-7(10)12/h6,11H,4-5H2,1-3H3/t6-/m0/s1
InChI Key:	GUVYWSACSIYEDN-LURJTMIESA-N
Boiling Point:	360.583 °C at 760 mmHg
Density:	1.254 g/cm³
Appearance:	Solid
LogP:	0.45260

Publication Number	Title	Priority Date
DE-60115935-T2	PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 4-HYDROXY-2-PYRROLIDINONE AND N-SUBSTITUTED 4-HYDROXY-2-PYRROLIDINONE BY ENZYMATIC HYDROXYLATION	20001013
EP-1197561-A1	Process for preparing optically active 4-hydroxy-2-pyrrolidinone and N-substituted 4-hydroxy-2-pyrrolidinones by enzymatic hydroxylation	20001013
EP-1325146-A2	Process for preparing optically active 4-hydroxy-2-pyrrolidinone and n-substituted 4-hydroxy-2-pyrrolidinones by enzymatic hydroxylation	20001013
EP-1325146-B1	Process for preparing optically active 4-hydroxy-2-pyrrolidinone and n-substituted 4-hydroxy-2-pyrrolidinones by enzymatic hydroxylation	20001013
US-2004009562-A1	Process for preparing optically active 4-hydroxy-2-pyrrolidinone and n-substituted 4-hydroxy-2-pyrrolidinones by enzymatic hydroxylation	20001013

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GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264+P265, P280, P305+P351+P338, and P337+P317
Signal Word:	Warning

Complexity:	256
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	201.10010796
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	201.10010796
Rotatable Bond Count:	2
Topological Polar Surface Area:	66.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0