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57800-68-7

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Basic Information
CAS No.: 57800-68-7
Name: (3-chlorophenyl)(2,4-dimethylphenyl)methanone
Molecular Structure:
Molecular Structure of 57800-68-7 ((3-chlorophenyl)(2,4-dimethylphenyl)methanone)
Formula: C15H13ClO
Molecular Weight: 244.721
Synonyms: Benzophenone,3'-chloro-2,4-dimethyl- (6CI);NSC 62530;
Density: 1.154 g/cm3
Boiling Point: 360.6 °C at 760 mmHg
Flash Point: 205.6 °C
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    Methanone,(3-chlorophenyl)(2,4-dimethylphenyl)- cas 57800-68-7Appearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Specification

The Methanone, (3-chlorophenyl)(2, 4-dimethylphenyl)-, with the CAS registry number of 57800-68-7, is also known as (3-Chlorophenyl)(2, 4-dimethylphenyl)methanone. This chemical's molecular formula is C15H13ClO and molecular weight is 244.7161. What's more, its IUPAC name is (3-Chlorophenyl)-(2, 4-dimethylphenyl)methanone.

Physical properties about Methanone, (3-chlorophenyl)(2, 4-dimethylphenyl)- are: (1)ACD/LogP: 4.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 17.07 Å2; (7)Index of Refraction: 1.58; (8)Molar Refractivity: 70.59 cm3; (9)Molar Volume: 212 cm3; (10)Surface Tension: 41.4 dyne/cm; (11)Density: 1.154 g/cm3; (12)Flash Point: 205.6 °C; (13)Enthalpy of Vaporization: 60.63 kJ/mol; (14)Boiling Point: 360.6 °C at 760 mmHg; (15)Vapour Pressure: 2.2E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1cc(Cl)ccc1)c2ccc(cc2C)C
(2) InChI: InChI=1/C15H13ClO/c1-10-6-7-14(11(2)8-10)15(17)12-4-3-5-13(16)9-12/h3-9H,1-2H3
(3) InChIKey: COFUWPXPXNYUOV-UHFFFAOYAK