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Benzyl-L-phenylalanine methyl ester hydrochloride

* Please kindly note that our products are not to be used for therapeutic purposes and cannot be sold to patients.

Category

L-Amino Acids

Catalog number

BAT-003897

CAS number

7703-09-5

Molecular Formula

C17H19NO2·HCl

Molecular Weight

305.81

Benzyl-L-phenylalanine methyl ester hydrochloride

Specification
Reference Reading

IUPAC Name

methyl (2S)-2-(benzylamino)-3-phenylpropanoate;hydrochloride

Synonyms

Bzl-L-Phe-OMe HCl; (S)-Methyl 2-(benzylamino)-3-phenylpropanoate hydrochloride

Appearance

White crystalline powder

Purity

≥ 99% (HPLC)

Melting Point

142-155 °C

Storage

Store at 2-8°C

InChI

InChI=1S/C17H19NO2.ClH/c1-20-17(19)16(12-14-8-4-2-5-9-14)18-13-15-10-6-3-7-11-15;/h2-11,16,18H,12-13H2,1H3;1H/t16-;/m0./s1

InChI Key

FKTZZMDPUTVSOH-NTISSMGPSA-N

Canonical SMILES

COC(=O)C(CC1=CC=CC=C1)NCC2=CC=CC=C2.Cl

1. l-Serine methyl ester hydro-chloride

Arie Schouten, Martin Lutz Acta Crystallogr Sect E Struct Rep Online. 2009 Nov 7;65(Pt 12):o3026. doi: 10.1107/S1600536809046480.

In the enanti-opure crystal of the title compound, C(4)H(10)NO(3) (+)·Cl(-), inter-molecular O-H⋯Cl and N-H⋯Cl hydrogen bonds link the mol-ecules into layers parallel to (001).

2. L-histidine methyl ester dihydrochloride

V H Vilchiz, R E Norman, S C Chang Acta Crystallogr C. 1996 Mar 15;52 ( Pt 3):696-8. doi: 10.1107/s0108270195013308.

The title compound, C7H13N3O2(2+).2Cl-, has distances and angles quite similar to those of histidine hydrochloride monohydrate [Donohue & Caron (1964). Acta Cryst. 17, 1178-1180], except for the distances within the ester functionality.