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5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine

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Name

5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine

EINECS N/A
CAS No. 502686-25-1 Density 1.483
PSA 114.14000 LogP 1.33920
Solubility N/A Melting Point N/A
Formula C9H9 N5 O2 Boiling Point 512.8°C at 760 mmHg
Molecular Weight 219.20 Flash Point 263.9°C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 502686-25-1 (5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine) Hazard Symbols N/A
Synonyms

1H-1,2,4-Triazol-3-amine,5-[(2-nitrophenyl)methyl]- (9CI)

 

5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine Chemical Properties

Molecular structure of 5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine (CAS NO.502686-25-1) is:

Product Name: 5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine
CAS Registry Number: 502686-25-1
Molecular Formula: C9H9N5O2
Molecular Weight: 219.20
Index of Refraction: 1.697 
Molar Refractivity: 56.96 cm3 
Molar Volume: 147.7 cm3
Surface Tension: 84.2 dyne/cm 
Density: 1.483 g/cm3 
Flash Point: 263.9 °C 
Enthalpy of Vaporization: 78.41 kJ/mol 
Boiling Point: 512.8 °C at 760 mmHg 
Vapour Pressure: 1.25E-10 mmHg at 25 °C 
SMILES: [O-][N+](=O)c1ccccc1Cc2nc(nn2)N 
InChI: InChI=1/C9H9N5O2/c10-9-11-8(12-13-9)5-6-3-1-2-4-7(6)14(15)16/h1-4H,5H2,(H3,10,11,12,13) 
InChIKey: MODDVXMNVIWQNS-UHFFFAOYAS

5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine Specification

 5-(2-Nitrobenzyl)-4H-1,2,4-triazol-3-amine , its cas register number is 502686-25-1. It also can be called 1H-1,2,4-Triazol-5-amine,3-[(2-nitrophenyl)methyl]- .

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