1-(Chlorophenylmethyl)-4-fluorobenzene supplier

Name
1-(chlorophenylmethyl)-4-fluorobenzene
EINECS 206-670-2
CAS No. 365-21-9
Article Data12
CAS DataBase
Density 1.191 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₀ClF
Boiling Point 294.8 °C at 760mmHg
Molecular Weight 220.674
Flash Point 139.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methane,chloro(p-fluorophenyl)phenyl- (6CI,7CI,8CI);4-Fluorobenzhydryl chloride;
PSA 0.00000
LogP 4.15390

1-(Chlorophenylmethyl)-4-fluorobenzene Specification

The IUPAC name of this chemical is 1-[chloro(phenyl)methyl]-4-fluorobenzene. With the CAS registry number 365-21-9 and EINECS 206-670-2, it is also named as Benzene, 1-(chlorophenylmethyl)-4-fluoro-. The formula is C₁₃H₁₀ClF and the molecular weight is 220.669903.

The other characteristics of 1-(Chlorophenylmethyl)-4-fluorobenzene can be summarized as: (1)ACD/LogP: 4.01; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 0 Å²; (7)Index of Refraction: 1.566; (8)Molar Refractivity: 60.41 cm³; (9)Molar Volume: 185.1 cm³; (10)Polarizability: 23.94×10^-24 cm³; (11)Surface Tension: 38.9 dyne/cm; (12)Enthalpy of Vaporization: 51.31 kJ/mol; (13)Boiling Point: 294.8 °C at 760 mmHg; (14)Vapour Pressure: 0.00279 mmHg at 25°C; (15)Rotatable Bond Count: 2; (16)Exact Mass: 220.045506; (17)MonoIsotopic Mass: 220.045506; (18)Heavy Atom Count: 15; (19)Complexity: 181; (20)Undefined Atom StereoCenter Count: 1.

People can use the following data to convert to the molecule structure.
1. SMILES:ClC(c1ccc(F)cc1)c2ccccc2
2. InChI:InChI=1/C13H10ClF/c14-13(10-4-2-1-3-5-10)11-6-8-12(15)9-7-11/h1-9,13H
3. InChIKey:GNFODANOHXAUPE-UHFFFAOYAS
4. Std. InChI:InChI=1S/C13H10ClF/c14-13(10-4-2-1-3-5-10)11-6-8-12(15)9-7-11/h1-9,13H
5. Std. InChIKey:GNFODANOHXAUPE-UHFFFAOYSA-N

Product Name

1-(chlorophenylmethyl)-4-fluorobenzene

1-(Chlorophenylmethyl)-4-fluorobenzene Specification

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