(S)-3-(Cbz-amino)butyric Acid - CAS 83509-88-0

Catalog:	BB037045
Product Name:	(S)-3-(Cbz-amino)butyric Acid
CAS:	83509-88-0
Synonyms:	(3S)-3-(phenylmethoxycarbonylamino)butanoic acid; (3S)-3-(phenylmethoxycarbonylamino)butanoic acid

Technical Data

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Computed Properties

IUPAC Name:	(3S)-3-(phenylmethoxycarbonylamino)butanoic acid
Description:	(S)-3-(Cbz-amino)butyric Acid (CAS# 83509-88-0) is a useful research chemical.
Molecular Weight:	237.25
Molecular Formula:	C12H15NO4
Canonical SMILES:	CC(CC(=O)O)NC(=O)OCC1=CC=CC=C1
InChI:	InChI=1S/C12H15NO4/c1-9(7-11(14)15)13-12(16)17-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,13,16)(H,14,15)/t9-/m0/s1
InChI Key:	HYWJKPFAIAWVHP-VIFPVBQESA-N
MDL:	MFCD08277048
LogP:	1.98040

Publication Number	Title	Priority Date
US-2020190045-A1	Ferroportin inhibitors and methods of use	20181213
WO-2020123850-A1	Ferroportin inhibitors and methods of use	20181213
EP-3894416-A1	Ferroportin inhibitors and methods of use	20181213
US-2019077850-A1	Pathogen binding methods and compositions	20170810
US-10273283-B2	Modified integrin polypeptides, modified integrin polypeptide dimers, and uses thereof	20140806

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Complexity:	261
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	237.10010796
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	237.10010796
Rotatable Bond Count:	6
Topological Polar Surface Area:	75.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4