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3-(2H-Tetrazol-2-Yl)Alanine
[CAS# 405150-16-5]

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Identification
Classification Biochemical >> Amino acids and their derivatives >> Alanine derivatives
Name 3-(2H-Tetrazol-2-Yl)Alanine
Synonyms (S)-2-AMINO-3-(2-TETRAZOLYL)PROPIONIC ACID; 3-(2-Tetrazolyl)-L-alanine
Molecular Structure CAS#: 405150-16-5, 3-(2H-Tetrazol-2-Yl)Alanine
Molecular Formula C4H7N5O2
Molecular Weight 157.13
CAS Registry Number 405150-16-5
SMILES O=C(O)C(N)Cn1ncnn1
InChI 1S/C4H7N5O2/c5-3(4(10)11)1-9-7-2-6-8-9/h2-3H,1,5H2,(H,10,11)
InChIKey PBUXSPZZJMCMSU-UHFFFAOYSA-N
Properties
Density 1.857g/cm3 (Cal.)
Boiling point 403.809°C at 760 mmHg (Cal.)
Flash point 198.017°C (Cal.)
Refractive index 1.77 (Cal.)
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