2-Phenyl-1,2,3-triazole supplier

Name
2-Phenyl-2H-1,2,3-triazole
EINECS
CAS No. 51039-49-7
Article Data19
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point 162℃
Formula C₈H₇N₃
Boiling Point 280.2 °C at 760 mmHg
Molecular Weight 145.164
Flash Point 123.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Phenyl-2H-1,2,3-triazole;2H-1,2,3-triazole, 2-phenyl-;
PSA 30.71000
LogP 1.26730

2-Phenyl-1,2,3-triazole Specification

The CAS register number of 2-Phenyl-1,2,3-triazole is 51039-49-7. It also can be called as 2H-1,2,3-triazole, 2-phenyl- and the systematic name about this chemical is 2-phenyl-2H-1,2,3-triazole. The molecular formula about this chemical is C₈H₇N₃ and the molecular weight is 145.1613.

Physical properties about 2-Phenyl-1,2,3-triazole are: (1)ACD/LogP: 1.80; (2)ACD/LogD (pH 5.5): 1.8; (3)ACD/LogD (pH 7.4): 1.8; (4)ACD/BCF (pH 5.5): 13.79; (5)ACD/BCF (pH 7.4): 13.79; (6)ACD/KOC (pH 5.5): 227.63; (7)ACD/KOC (pH 7.4): 227.63; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 30.71 Å²; (11)Index of Refraction: 1.632; (12)Molar Refractivity: 44.37 cm³; (13)Molar Volume: 124.3 cm³; (14)Polarizability: 17.59x10^-24cm³; (15)Surface Tension: 47.9 dyne/cm; (16)Density: 1.16 g/cm³; (17)Flash Point: 123.2 °C; (18)Enthalpy of Vaporization: 51.89 kJ/mol; (19)Boiling Point: 280.2 °C at 760 mmHg; (20)Vapour Pressure: 0.00385 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ccnn1c2ccccc2
(2)InChI: InChI=1/C8H7N3/c1-2-4-8(5-3-1)11-9-6-7-10-11/h1-7H
(3)InChIKey: JYBWAYHAOLQZJX-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H7N3/c1-2-4-8(5-3-1)11-9-6-7-10-11/h1-7H
(5)Std. InChIKey: JYBWAYHAOLQZJX-UHFFFAOYSA-N

Product Name

2-Phenyl-2H-1,2,3-triazole

2-Phenyl-1,2,3-triazole Specification

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