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Structure

L-Histidine mono[3-(1H-imidazol-4-yl)acrylate]

CAS
85586-47-6
Catalog Number
ACM85586476
Category
Other Products
Molecular Weight
293.278600 [g/mol]
Molecular Formula
C6H9N3O2.C6H6N2O2

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Specification

Synonyms
EINECS 287-850-8, L-Histidine mono(3-(1H-imidazol-4-yl)acrylate), 85586-47-6
IUPAC Name
(2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid;(E)-3-(1H-imidazol-5-yl)prop-2-enoic acid
Canonical SMILES
C1=C(NC=N1)CC(C(=O)O)N.C1=C(NC=N1)C=CC(=O)O
InChI Key
KJXYHPVSKYVDPW-OSRGESDQSA-N
EC Number
287-850-8
Exact Mass
293.11200
H-Bond Acceptor
7
H-Bond Donor
5
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