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1008526-84-8

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Basic Information
CAS No.: 1008526-84-8
Name: 4H-1,2,4-Triazole-4-ethanamine
Molecular Structure:
Molecular Structure of 1008526-84-8 (4H-1,2,4-Triazole-4-ethanamine)
Formula: C4H8N4
Molecular Weight: 112.1331
Synonyms: 4H-1,2,4-Triazole-4-ethanamine;2-(4H-1,2,4-TRIAZOL-4-YL)ETHANAMINE;2-(4H-1,2,4-triazol-4-yl)ethanamine(SALTDATA: 2HCl)
Density: 1.31 g/cm3
Boiling Point: 266.3 °C at 760 mmHg
Flash Point: 114.9 °C
PSA: 56.73000
LogP: -0.06290
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Specification

This chemical is called 2-(4H-1,2,4-Triazol-4-yl)ethanamine, and its systematic name is 2-(1,2,4-triazol-4-yl)ethanamine. With the molecular formula of C4H8N4, its molecular weight is 112.1331. The CAS registry number of this chemical is 1008526-84-8.

Other characteristics of the 2-(4H-1,2,4-Triazol-4-yl)ethanamine can be summarised as followings: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 56.73 Å2; (5)Index of Refraction: 1.633; (6)Molar Refractivity: 30.4 cm3; (7)Molar Volume: 85 cm3; (8)Polarizability: 12.05×10-24cm3; (9)Surface Tension: 58 dyne/cm; (10)Density: 1.31 g/cm3; (11)Flash Point: 114.9 °C; (12)Enthalpy of Vaporization: 50.43 kJ/mol; (13)Boiling Point: 266.3 °C at 760 mmHg; (14)Vapour Pressure: 0.00869 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1nncn1CCN
2.InChI: InChI=1/C4H8N4/c5-1-2-8-3-6-7-4-8/h3-4H,1-2,5H2
3.InChIKey: ATCZRYPJBPXFIN-UHFFFAOYAH