trans-3-(Boc-amino)-4-hydroxypyrrolidine - CAS 870632-89-6

Catalog:	BB038190
Product Name:	trans-3-(Boc-amino)-4-hydroxypyrrolidine
CAS:	870632-89-6
Synonyms:	N-[(3S,4S)-4-hydroxy-3-pyrrolidinyl]carbamic acid tert-butyl ester; tert-butyl N-[(3S,4S)-4-hydroxypyrrolidin-3-yl]carbamate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl N-[(3S,4S)-4-hydroxypyrrolidin-3-yl]carbamate
Description:	trans-3-(Boc-amino)-4-hydroxypyrrolidine (CAS# 870632-89-6) is a useful research chemical.
Molecular Weight:	202.25
Molecular Formula:	C9H18N2O3
Canonical SMILES:	CC(C)(C)OC(=O)NC1CNCC1O
InChI:	InChI=1S/C9H18N2O3/c1-9(2,3)14-8(13)11-6-4-10-5-7(6)12/h6-7,10,12H,4-5H2,1-3H3,(H,11,13)/t6-,7-/m0/s1
InChI Key:	QAZVTJCOYJOJGO-BQBZGAKWSA-N
LogP:	0.56350

Publication Number	Title	Priority Date
WO-2021050612-A1	Compositions and methods for the treatment of respiratory syncytial virus	20190909
WO-2020252396-A1	Compositions and methods for the treatment of respiratory syncytial virus	20190613
EP-3825303-A1	T-type calcium channel blocker	20180717
BR-112020024782-A2	tetrahydro-1h-pyrazine [2,1-a] isoindolylquinoline compounds for the treatment of autoimmune disease	20180605
WO-2019152883-A1	Inhibitors of protein arginine deiminases	20180202

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Complexity:	213
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	202.13174244
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	202.13174244
Rotatable Bond Count:	3
Topological Polar Surface Area:	70.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3