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Basic Information
CAS No.: 7510-28-3
Name: 1-(Chloromethyl)-2-(phenylmethyl)benzene
Molecular Structure:
Molecular Structure of 7510-28-3 (1-(Chloromethyl)-2-(phenylmethyl)benzene)
Formula: C14H13Cl
Molecular Weight: 216.71
Synonyms: 1-(Chloromethyl)-2-benzylbenzene;
EINECS: 231-367-7
Density: 1.102 g/cm3
Boiling Point: 318.5 °C at 760 mmHg
Flash Point: 141.1 °C
PSA: 0.00000
LogP: 4.01620
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Specification

The 1-(Chloromethyl)-2-(phenylmethyl)benzene, with the CAS registry number 7510-28-3, is also known as 1-(Chloromethyl)-2-benzylbenzene. And its EINECS registry number is 231-367-7. This chemical's molecular formula is C14H13Cl and molecular weight is 216.71. What's more, its IUPAC name is 1-Benzyl-2-(chloromethyl)benzene.

Physical properties about 1-(Chloromethyl)-2-(phenylmethyl)benzene are: (1)ACD/LogP: 4.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.5; (4)ACD/LogD (pH 7.4): 4.5; (5)ACD/BCF (pH 5.5): 1549.21; (6)ACD/BCF (pH 7.4): 1549.21; (7)ACD/KOC (pH 5.5): 6684.66; (8)ACD/KOC (pH 7.4): 6684.66; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 65.33 cm3; (15)Molar Volume: 196.5 cm3; (16)Polarizability: 25.89×10-24 cm3; (17)Surface Tension: 39.7 dyne/cm; (18)Density: 1.102 g/cm3; (19)Flash Point: 141.1 °C; (20)Enthalpy of Vaporization: 53.77 kJ/mol; (21)Boiling Point: 318.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000669 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClCc1ccccc1Cc2ccccc2
(2) InChI: InChI=1S/C14H13Cl/c15-11-14-9-5-4-8-13(14)10-12-6-2-1-3-7-12/h1-9H,10-11H2
(3) InChIKey: LPCDKGCUDQLTIX-UHFFFAOYSA-N