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CAS Number: 2734-48-7
(S)-2-amino-3-(1H-pyrazol-1-yl)propanoic acid

Structure

(S)-2-amino-3-(1H-pyrazol-1-yl)propanoic acid
Name: (S)-2-amino-3-(1H-pyrazol-1-yl)propanoic acid
Synonyms:
General Information
Product Number: 2734487
CAS Registry Number: 2734-48-7
Name:
        1H-​Pyrazole-​1-​propanoic acid, α-​amino-​, (αS)​-
        1H-​Pyrazole-​1-​propanoic acid, α-​amino-​, (S)​-; Pyrazole-​1-​propionic acid, α-​amino-​, L- (8CI); L-​β-​(1-​Pyrazolyl)​alanine; β-​(Pyrazol-​1-​yl)​-​L-​alanine; β-​Pyrazolyl-​L-​alanine 
 
Chemical Formula: C6H9N3O2
Exact Mass: 155.07
Molecular Weight: 155.15
m/z: 155.07 (100.0%), 156.07 (7.7%)
Elemental Analysis: C, 46.45; H, 5.85; N, 27.08; O, 20.62
 
InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)4-9-3-1-2-8-9/h1-3,5H,4,7H2,(H,10,11)/t5-/m0/s1
InChIKey: PIGOPELHGLPKLL-YFKPBYRVSA-N
Canonical SMILES : C1=CN(N=C1)CC(C(=O)O)N
Isomeric SMILES: C1=CN(N=C1)C[C@@H](C(=O)O)N
 
Thermal Properties Value Condition Note
Melting Point 243-244 °C (decomp)   (2)CAS

Specification

98%

References
  1. (1) Arnold, Lee D.; Journal of the American Chemical Society 1988, V110(7), P2237-41 CAPLUS
  2. (2) Sugimoto, N.; Tetrahedron 1960, V11, P231-3 CAPLUS
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