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CAS No.: | 455-31-2 |
---|---|
Name: | (DIFLUOROMETHYL)BENZENE |
Article Data: | 65 |
Molecular Structure: | |
Formula: | C7H6F2 |
Molecular Weight: | 128.121 |
Synonyms: | (Difluoromethyl)benzene;Toluene, a,a-difluoro- (6CI,7CI,8CI);a,a-Difluorotoluene;Benzal fluoride; |
Density: | 1.091 g/cm3 |
Boiling Point: | 140 °C at 760 mmHg |
Flash Point: | 20.3 °C |
Hazard Symbols: | Xi |
Risk Codes: | 10-34 |
Safety: | 26-36/37/39-45 |
PSA: | 0.00000 |
LogP: | 2.62420 |
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The Benzene,(difluoromethyl)- is an organic compound with the formula C7H6F2. The IUPAC name of this chemical is Difluoromethylbenzene. The CAS registry number of this chemical is 455-31-2. Besides, its molecular weight is 128.1204.
Physical properties about Benzene,(difluoromethyl)- are: (1)ACD/LogP: 2.59; (2)ACD/LogD (pH 5.5): 2.59; (3)ACD/LogD (pH 7.4): 2.59; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.449; (6)Molar Refractivity: 31.49 cm3; (7)Molar Volume: 117.3 cm3; (8)Polarizability: 12.48×10-24 cm3; (9)Surface Tension: 24.7 dyne/cm; (10)Density: 1.091 g/cm3; (11)Flash Point: 20.3 °C; (12)Enthalpy of Vaporization: 36.17 kJ/mol; (13)Boiling Point: 140 °C at 760 mmHg; (14)Vapour Pressure: 7.81 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)c1ccccc1
(2)InChI: InChI=1/C7H6F2/c8-7(9)6-4-2-1-3-5-6/h1-5,7H
(3)InChIKey: JDZLOJYSBBLXQD-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C7H6F2/c8-7(9)6-4-2-1-3-5-6/h1-5,7H
(5)Std. InChIKey: JDZLOJYSBBLXQD-UHFFFAOYSA-N