5-Fluorobenzoxazole supplier | CasNO.221347-71-3

Name
5-Fluorobenzoxazole
EINECS
CAS No. 221347-71-3
Article Data8
CAS DataBase
Density 1.321 g/cm³
Solubility
Melting Point
Formula C₇H₄FNO
Boiling Point 188.186 °C at 760 mmHg
Molecular Weight 137.113
Flash Point 67.613 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Fluorobenzoxazole;2-Chloro-6-methyl-4-(trifluoromethyl)pyridine;
PSA 26.03000
LogP 1.96690

5-Fluorobenzoxazole Specification

The 5-Fluorobenzoxazole with the cas number 221347-71-3 is also called Benzoxazole, 5-fluoro-. The systematic name is 5-fluoro-1,3-benzoxazole. Its molecular formula is C₇H₄FNO. This chemical belongs to the following product categories: (1)halide; (2)API intermediates.

The properties of the chemical are: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 10; (6)ACD/BCF (pH 7.4): 10; (7)ACD/KOC (pH 5.5): 186; (8)ACD/KOC (pH 7.4): 186; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 26.03 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 34.48 cm³; (15)Molar Volume: 103.777 cm³; (16)Polarizability: 13.669×10^-24cm³; (17)Surface Tension: 43.397 dyne/cm; (18)Enthalpy of Vaporization: 40.702 kJ/mol; (19)Vapour Pressure: 0.837 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc2ncoc2cc1
(2)InChI: InChI=1/C7H4FNO/c8-5-1-2-7-6(3-5)9-4-10-7/h1-4H
(3)InChIKey: ZRMPAEOUOPNNPZ-UHFFFAOYAN

Product Name

5-Fluorobenzoxazole

5-Fluorobenzoxazole Specification

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