CAS No.72867-72-2,2-Chlorophenyl benzyl ketone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	72867-72-2
Name:	2-Chlorophenyl benzyl ketone
Article Data:	18

Formula:	C₁₄H₁₁ClO
Molecular Weight:	230.694
Synonyms:	Acetophenone,2'-chloro-2-phenyl- (6CI);1-(2-Chlorophenyl)-2-phenylethanone;Benzyl2-chlorophenyl ketone;2'-Chloro-2-phenylacetophenone;
Density:	1.191 g/cm³
Boiling Point:	330.231 °C at 760 mmHg
Flash Point:	184.713 °C
PSA:	17.07000
LogP:	3.76540

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Specification

The CAS register number of 2-Chlorophenyl benzyl ketone is 72867-72-2. It also can be called as 2'-Chloro-2-phenylacetophenone and the systematic name about this chemical is 1-(2-chlorophenyl)-2-phenylethanone. The molecular formula about this chemical is C₁₄H₁₁ClO and the molecular weight is 230.69.

Physical properties about 2-Chlorophenyl benzyl ketone are: (1)ACD/LogP: 3.60; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 323; (5)ACD/BCF (pH 7.4): 323; (6)ACD/KOC (pH 5.5): 2176; (7)ACD/KOC (pH 7.4): 2176; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 17.07Å²; (11)Index of Refraction: 1.594; (12)Molar Refractivity: 65.663 cm³; (13)Molar Volume: 193.616 cm³; (14)Polarizability: 26.031x10^-24cm³; (15)Surface Tension: 44.643 dyne/cm; (16)Enthalpy of Vaporization: 57.279 kJ/mol; (17)Boiling Point: 330.231 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Cc1ccccc1)c2ccccc2Cl
(2)InChI: InChI=1/C14H11ClO/c15-13-9-5-4-8-12(13)14(16)10-11-6-2-1-3-7-11/h1-9H,10H2
(3)InChIKey: PYTHIEVNGSYRFO-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C14H11ClO/c15-13-9-5-4-8-12(13)14(16)10-11-6-2-1-3-7-11/h1-9H,10H2
(5)Std. InChIKey: PYTHIEVNGSYRFO-UHFFFAOYSA-N