Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(3-Bromo-2-fluoro-phenyl)methanol |
EINECS | N/A |
CAS No. | 261723-32-4 | Density | 1.658 g/cm3 |
PSA | 20.23000 | LogP | 2.08050 |
Solubility | N/A | Melting Point |
36.0 to 40.0 °C |
Formula | C7H6BrFO | Boiling Point | 263.232 °C at 760 mmHg |
Molecular Weight | 205.026 | Flash Point | 112.999 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(3-Bromo-2-fluorophenyl)methanol;3-Bromo-2-fluorobenzyl alcohol; |
Article Data | 10 |
The Benzenemethanol,3-bromo-2-fluoro-, with the CAS registry number 261723-32-4, is also known as 3-Bromo-2-fluorobenzyl alcohol. This chemical's molecular formula is C7H6BrFO and molecular weight is 203.96. What's more, both its IUPAC name and systematic name are the same which is called (3-Bromo-2-fluoro-phenyl)methanol.
Physical properties about Benzenemethanol,3-bromo-2-fluoro- are: (1)ACD/LogP: 1.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.286; (4)ACD/LogD (pH 7.4): 1.286; (5)ACD/BCF (pH 5.5): 5.594; (6)ACD/BCF (pH 7.4): 5.594; (7)ACD/KOC (pH 5.5): 119.352; (8)ACD/KOC (pH 7.4): 119.352; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.567; (14)Molar Refractivity: 40.388 cm3; (15)Molar Volume: 123.644 cm3; (16)Surface Tension: 43.994 dyne/cm; (17)Density: 1.658 g/cm3; (18)Flash Point: 112.999 °C; (19)Enthalpy of Vaporization: 52.935 kJ/mol; (20)Boiling Point: 263.232 °C at 760 mmHg; (21)Vapour Pressure: 0.005 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(c(c(c1)Br)F)CO
(2) InChI: InChI=1S/C7H6BrFO/c8-6-3-1-2-5(4-10)7(6)9/h1-3,10H,4H2
(3) InChIKey: LIZLYZVAYZQVPG-UHFFFAOYSA-N