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CAS Number: 76410-58-7
(S)-2-amino-3-(4-boronophenyl)propanoic acid

Structure

 (S)-2-amino-3-(4-boronophenyl)propanoic acid
Name: (S)-2-amino-3-(4-boronophenyl)propanoic acid
Synonyms:
General Information
Product Number: 76410587

CAS Registry Number 76410-58-7
Name:
L-?Phenylalanine, 4-?borono-
4-(Dihydroxyboryl)-L-phenylalanine
4-Borono-L-phenylalanine
L-BPA
L-p-Boronophenylalanine

 

Chemical Formula: C9H12BNO4
Exact Mass: 209.09
Molecular Weight: 209.01
m/z: 209.09 (100.0%), 208.09 (24.2%), 210.09 (10.0%), 211.09 (1.3%)

 

InChI:InChI=1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m0/s1

InChI Key:NFIVJOSXJDORSP-QMMMGPOBSA-N

Canonical SMILES:B(C1=CC=C(C=C1)CC(C(=O)O)N)(O)O

Specification

98%
References
  1. (4) Malan, Christophe; Journal of Organic Chemistry 1998, V63(22), P8019-8020 CAPLUS
  2. (5) Nakamura, Hiroyuki; Journal of Organic Chemistry 1998, V63(21), P7529-7530 CAPLUS
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