6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole supplier

Name
6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole
EINECS
CAS No. 944718-32-5
Density 1.78 g/cm³
Solubility
Melting Point
Formula C₇H₈BrN₃
Boiling Point 268 °C
Molecular Weight 214.06
Flash Point 116 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-bromo-1-methyl-1H-benzo[d][1,2,3]triazole
PSA 30.71000
LogP 1.73080

6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole Specification

This chemical is called 6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole, and it can also be named as 1H-1,2,3-benzotriazole, 6-bromo-1-methyl-. With the molecular formula of C₇H₈BrN₃, its molecular weight is 214.06. The CAS registry number of this chemical is 944718-32-5.

Other characteristics of the 6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole can be summarised as followings: (1)ACD/LogP: 1.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.83; (4)ACD/LogD (pH 7.4): 1.83; (5)ACD/BCF (pH 5.5): 14.45; (6)ACD/BCF (pH 7.4): 14.45; (7)ACD/KOC (pH 5.5): 235.39; (8)ACD/KOC (pH 7.4): 235.39; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 30.71 Å²; (13)Index of Refraction: 1.714; (14)Molar Refractivity: 47.13 cm³; (15)Molar Volume: 119.9 cm³; (16)Polarizability: 18.68×10^-24cm³; (17)Surface Tension: 53.6 dyne/cm; (18)Density: 1.76 g/cm³; (19)Flash Point: 154.9 °C; (20)Enthalpy of Vaporization: 55.25 kJ/mol; (21)Boiling Point: 332.6 °C at 760 mmHg; (22)Vapour Pressure: 0.000279 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Cn1c2cc(ccc2nn1)Br
2.InChI: InChI=1/C7H6BrN3/c1-11-7-4-5(8)2-3-6(7)9-10-11/h2-4H,1H3
3.InChIKey: GPKHIVIGTSWNRM-UHFFFAOYAZ

Product Name

6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole

6-Bromo-1-methyl-1H-benzo[d][1,2,3]triazole Specification

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