L-Valine,N-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-,methyl ester,hydrochloride(1:1)

CAS

482577-59-3

Catalog Number

ACM482577593

Category

Other Products

Molecular Weight

358.86

Molecular Formula

C₂₀H₂₂N₂O₂.ClH

MSDS COA Spec Sheet

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Specification

Synonyms

L-VALINE, N-[(2'-CYANO[1,1'-BIPHENYL]-4-YL)METHYL]-, METHYL ESTER, MONOHYDROCHLORIDE;N-[(2'-cyano[1,1'biphenyl]-4-yl)methyl]-methyl ester L-valine monohydrochloride

IUPAC Name

methyl (2S)-2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methylbutanoate;hydrochloride

Canonical SMILES

CC(C)C(C(=O)OC)NCC1=CC=C(C=C1)C2=CC=CC=C2C#N.Cl

InChI Key

AZQXUWUZQLZNIM-FYZYNONXSA-N

Melting Point

186ºC

EC Number

610-414-9

Exact Mass

358.14500

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

6306-52-1
114772-54-2

482577-59-3

Reference: [1]Current Patent Assignee: JUBILANT PHARMOVA LTD - WO2012/56294, 2012, A1
Location in patent: Page/Page column 14
[2]Current Patent Assignee: QINGDAO XUEJIE CHEMICALS - CN103923028, 2017, B
Location in patent: Paragraph 0055-0056
[3]Current Patent Assignee: HETERO DRUGS LIMITED - US2022/127238, 2022, A1
Location in patent: Paragraph 0102

Downstream Synthesis Route 1

482577-59-3

137863-89-9

Reference: [1]Current Patent Assignee: SATYANARAYANA REDDY, Manne; KISHORE KUMAR, Muppa; RAMA SUBBA REDDY, Karamala - WO2008/7391, 2008, A2
Location in patent: Page/Page column 16