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CAS No.: | 261762-56-5 |
---|---|
Name: | 3-Chloro-2-fluoroanisole |
Molecular Structure: | |
Formula: | C7H6ClFO |
Molecular Weight: | 160.575 |
Synonyms: | 1-Chloro-2-fluoro-3-methoxybenzene |
Density: | 1.239 g/cm3 |
Boiling Point: | 197.5 °C at 760 mmHg |
Flash Point: | 73.2 °C |
Hazard Symbols: | F,Xi |
PSA: | 9.23000 |
LogP: | 2.48770 |
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The 3-Chloro-2-fluoroanisole, with the CAS registry number 261762-56-5, is also known as Benzene, 1-chloro-2-fluoro-3-methoxy-. This chemical's molecular formula is C7H6ClFO and molecular weight is 160.573343. Its IUPAC name is called 1-chloro-2-fluoro-3-methoxybenzene.
Physical properties of 3-Chloro-2-fluoroanisole: (1)ACD/LogP: 3.07; (2)ACD/LogD (pH 5.5): 3.07; (3)ACD/LogD (pH 7.4): 3.07; (4)ACD/BCF (pH 5.5): 127.2; (5)ACD/BCF (pH 7.4): 127.2; (6)ACD/KOC (pH 5.5): 1116.84; (7)ACD/KOC (pH 7.4): 1116.84; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.495; (11)Molar Refractivity: 37.82 cm3; (12)Molar Volume: 129.5 cm3; (13)Surface Tension: 31.4 dyne/cm; (14)Density: 1.239 g/cm3; (15)Flash Point: 73.2 °C; (16)Enthalpy of Vaporization: 41.59 kJ/mol; (17)Boiling Point: 197.5 °C at 760 mmHg; (18)Vapour Pressure: 0.532 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical that may catch fire in contact with air and may cause inflammation to the skin or other mucous membranes. In addition, this chemical only need brief contact with an ignition source which has a very low flash point or evolve highly flammable gases in contact with water.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=C(C(=CC=C1)Cl)F
(2)InChI: InChI=1S/C7H6ClFO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3
(3)InChIKey: CVFVXCYDOOGQCJ-UHFFFAOYSA-N