1,2-Benzisoxazole,5-bromo- supplier

Name
1,2-BENZISOXAZOLE, 5-BROMO-
EINECS
CAS No. 837392-65-1
Article Data7
CAS DataBase
Density 1.711 g/cm³
Solubility
Melting Point
Formula C₇H₄BrNO
Boiling Point 276.122 °C at 760 mmHg
Molecular Weight 198.019
Flash Point 120.794 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-1,2-benzoxazole;
PSA 26.03000
LogP 2.59030

1,2-Benzisoxazole,5-bromo- Specification

This chemical is called 1,2-Benzisoxazole,5-bromo-, and it can also be named as 5-bromo-1,2-benzoxazole. With the molecular formula of C₇H₄BrNO, its molecular weight is 198.02. The CAS registry number of this chemical is 837392-65-1.

Other characteristics of the1,2-Benzisoxazole,5-bromo- can be summarised as followings: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 26.03 Å²; (7)Index of Refraction: 1.649; (8)Molar Refractivity: 42.176 cm³; (9)Molar Volume: 115.752 cm³; (10)Polarizability: 16.72 ×10^-24cm³; (11)Surface Tension: 51.264 dyne/cm ; (12)Density: 1.711 g/cm³; (13)Flash Point: 120.794 °C; (14)Enthalpy of Vaporization: 49.392 kJ/mol; (15)Boiling Point: 276.122 °C at 760 mmHg; (16)Vapour Pressure: 0.008 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Brc2cc1c(onc1)cc2
2.InChI: InChI=1/C7H4BrNO/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H
3.InChIKey: XAGKLUNARLSYDT-UHFFFAOYAS

Product Name

1,2-BENZISOXAZOLE, 5-BROMO-

1,2-Benzisoxazole,5-bromo- Specification

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