Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Benzamide, 4-bromo-2-fluoro- |
EINECS | N/A |
CAS No. | 292621-45-5 | Density | 1.696 g/cm3 |
PSA | 44.08000 | LogP | 2.57130 |
Solubility | N/A | Melting Point |
151-153℃ |
Formula | C7H5BrFNO | Boiling Point | 261 °C at 760 mmHg |
Molecular Weight | 218.025 | Flash Point | 111.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-Bromo-2-fluorobenzamide; |
Article Data | 11 |
The Benzamide, 4-bromo-2-fluoro- has the CAS registry number 292621-45-5. This chemical's molecular formula is C7H5BrFNO and molecular weight is 218.02. What's more, its systematic name is 4-bromo-2-fluorobenzamide.
Physical properties of Benzamide, 4-bromo-2-fluoro- are: (1)ACD/LogP: 1.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.65; (4)ACD/BCF (pH 5.5): 10.56; (5)ACD/KOC (pH 5.5): 188.09; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 20.31 Å2; (10)Index of Refraction: 1.581; (11)Molar Refractivity: 42.86 cm3; (12)Molar Volume: 128.5 cm3; (13)Polarizability: 16.99×10-24cm3; (14)Surface Tension: 48.5 dyne/cm; (15)Density: 1.696 g/cm3; (16)Flash Point: 111.6 °C; (17)Enthalpy of Vaporization: 49.87 kJ/mol; (18)Boiling Point: 261 °C at 760 mmHg; (19)Vapour Pressure: 0.0119 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1c(F)cc(Br)cc1)N
(2)InChI: InChI=1S/C7H5BrFNO/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H2,10,11)
(3)InChIKey: MJDRFCPNHLHNON-UHFFFAOYSA-N