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2-Amino-4-(4H-1,2,4-triazol-4-yl)benzoic acid
[CAS# 915920-19-3]

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Identification
Name 2-Amino-4-(4H-1,2,4-triazol-4-yl)benzoic acid
Synonyms 2-amino-4-(1,2,4-triazol-4-yl)benzoic acid; 2-amino-4-(4H-1,2,4-triazol-4-yl)benzoic acid; MFCD08691667
Molecular Structure CAS#: 915920-19-3, 2-Amino-4-(4H-1,2,4-triazol-4-yl)benzoic acid
Molecular Formula C9H8N4O2
Molecular Weight 204.19
CAS Registry Number 915920-19-3
SMILES c1cc(c(cc1n2cnnc2)N)C(=O)O
InChI 1S/C9H8N4O2/c10-8-3-6(13-4-11-12-5-13)1-2-7(8)9(14)15/h1-5H,10H2,(H,14,15)
InChIKey NEDSNKGNAVUYFJ-UHFFFAOYSA-N
Properties
Density 1.546g/cm3 (Cal.)
Boiling point 485.942°C at 760 mmHg (Cal.)
Flash point 247.689°C (Cal.)
Refractive index 1.728 (Cal.)
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