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Home >> Chemical Listing >> Page 581 >> (3-Amino-4-Cyano-1H-Pyrazol-1-Yl)Acetic Acid

(3-Amino-4-Cyano-1H-Pyrazol-1-Yl)Acetic Acid
[CAS# 156045-12-4]

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Identification
Name (3-Amino-4-Cyano-1H-Pyrazol-1-Yl)Acetic Acid
Synonyms 2-(3-amino-4-cyano-1H-pyrazol-1-yl)acetic acid
Molecular Structure CAS#: 156045-12-4, (3-Amino-4-Cyano-1H-Pyrazol-1-Yl)Acetic Acid
Molecular Formula C6H6N4O2
Molecular Weight 166.14
CAS Registry Number 156045-12-4
SMILES c1c(c(nn1CC(=O)O)N)C#N
InChI 1S/C6H6N4O2/c7-1-4-2-10(3-5(11)12)9-6(4)8/h2H,3H2,(H2,8,9)(H,11,12)
InChIKey ANTGEQXFHIBCHB-UHFFFAOYSA-N
Properties
Density 1.594g/cm3 (Cal.)
Boiling point 501.926°C at 760 mmHg (Cal.)
Flash point 257.356°C (Cal.)
Refractive index 1.698 (Cal.)
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