-
Name
2-FLUORO-6-METHOXYBENZYL ALCOHOL
- EINECS
- CAS No. 500912-17-4
- Density 1.488 g/cm3
- Solubility
- Melting Point 18-21°C
- Formula C8H9FO2
- Boiling Point 216 °C at 760 mmHg
- Molecular Weight 219.053
- Flash Point 102.4 °C
- Transport Information UN1760
- Appearance
- Safety
- Risk Codes 22
-
Molecular Structure
-
Hazard Symbols
C
- Synonyms 2-Fluoro-6-methoxybenzylbromide;2-Fluoro-6-methoxybenzyl alcohol;
- PSA 9.23000
- LogP 2.72920
Benzene,2-(bromomethyl)-1-fluoro-3-methoxy- Specification
The CAS register number of Benzene,2-(bromomethyl)-1-fluoro-3-methoxy- is 500912-17-4. It also can be called as 2-Fluoro-6-methoxybenzyl alcohol and the systematic name about this chemical is 2-(bromomethyl)-1-fluoro-3-methoxybenzene. The molecular formula about this chemical is C8H9FO2 and the molecular weight is 156.15. It belongs to the following product categories which include Aromatic Halides (substituted) and so on. This chemical may destroy living tissue on contact. It is corrosive and lachrymatory.
Physical properties about Benzene,2-(bromomethyl)-1-fluoro-3-methoxy- are: (1)ACD/LogP: 2.94; (2)ACD/LogD (pH 5.5): 2.94; (3)ACD/LogD (pH 7.4): 2.94; (4)ACD/BCF (pH 5.5): 100.33; (5)ACD/BCF (pH 7.4): 100.33; (6)ACD/KOC (pH 5.5): 942.42; (7)ACD/KOC (pH 7.4): 942.42; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 9.23 Å2; (11)Index of Refraction: 1.531; (12)Molar Refractivity: 45.57 cm3; (13)Molar Volume: 147.1 cm3; (14)Polarizability: 18.06x10-24cm3; (15)Surface Tension: 35.8 dyne/cm; (16)Density: 1.488 g/cm3; (17)Flash Point: 102.4 °C; (18)Enthalpy of Vaporization: 43.39 kJ/mol; (19)Boiling Point: 216 °C at 760 mmHg; (20)Vapour Pressure: 0.21 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(OC)c1CBr
(2)InChI: InChI=1/C8H8BrFO/c1-11-8-4-2-3-7(10)6(8)5-9/h2-4H,5H2,1H3
(3)InChIKey: PVKFBCBTHHTDEX-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H8BrFO/c1-11-8-4-2-3-7(10)6(8)5-9/h2-4H,5H2,1H3
(5)Std. InChIKey: PVKFBCBTHHTDEX-UHFFFAOYSA-N
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