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CAS No.: | 42908-77-0 |
---|---|
Name: | 2-TRIFLUOROMETHOXY TOLUENE |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C8H7F3O |
Molecular Weight: | 176.138 |
Synonyms: | 2-Methylphenyltrifluoromethyl ether;o-(Trifluoromethoxy)toluene; |
Density: | 1.206 g/cm3 |
Boiling Point: | 127.5 °C at 760 mmHg |
Flash Point: | 36.6 °C |
Hazard Symbols: | T |
PSA: | 9.23000 |
LogP: | 2.89360 |
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The Benzene,1-methyl-2-(trifluoromethoxy)-, with the CAS registry number 42908-77-0, is also known as ZINC14592875. This chemical's molecular formula is C8H7F3O and molecular weight is 176.044899. Its IUPAC name is called 1-methyl-2-(trifluoromethoxy)benzene. When you are using this chemical, please be cautious about it. This chemical that at low levels can cause damage to health.
Physical properties of Benzene,1-methyl-2-(trifluoromethoxy)-: (1)ACD/LogP: 3.63; (2)ACD/LogD (pH 5.5): 3.63; (3)ACD/LogD (pH 7.4): 3.63; (4)ACD/BCF (pH 5.5): 337.38; (5)ACD/BCF (pH 7.4): 337.38; (6)ACD/KOC (pH 5.5): 2245.07; (7)ACD/KOC (pH 7.4): 2245.07; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.436; (11)Molar Refractivity: 38.21 cm3; (12)Molar Volume: 146.1 cm3; (13)Surface Tension: 24.5 dyne/cm; (14)Density: 1.205 g/cm3; (15)Flash Point: 36.6 °C; (16)Enthalpy of Vaporization: 35.02 kJ/mol; (17)Boiling Point: 127.5 °C at 760 mmHg; (18)Vapour Pressure: 13.5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=CC=C1OC(F)(F)F
(2)InChI: InChI=1S/C8H7F3O/c1-6-4-2-3-5-7(6)12-8(9,10)11/h2-5H,1H3
(3)InChIKey: YFKPBFKOUVIQTN-UHFFFAOYSA-N