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6279-93-2

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Basic Information
CAS No.: 6279-93-2
Name: (2-bromophenyl)(2,4,6-trimethylphenyl)methanone
Article Data: 5
Molecular Structure:
Molecular Structure of 6279-93-2 ((2-bromophenyl)(2,4,6-trimethylphenyl)methanone)
Formula: C16H15BrO
Molecular Weight: 303.198
Synonyms: Benzophenone, 2'-bromo-2,4,6-trimethyl- (8CI);NSC 11022;
Density: 1.303 g/cm3
Boiling Point: 360.4 °C at 760 mmHg
Flash Point: 23.2 °C
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Specification

The Methanone, (2-bromophenyl)(2, 4, 6-trimethylphenyl)-, with the CAS registry number 6279-93-2, is also known as Benzophenone, 2'-bromo-2, 4, 6-trimethyl- (8CI). This chemical's molecular formula is C16H15BrO and molecular weight is 303.1937. What's more, its IUPAC name is (2-Bromophenyl)-(2, 4, 6-trimethylphenyl)methanone.

Physical properties about Methanone, (2-bromophenyl)(2, 4, 6-trimethylphenyl)- are: (1)ACD/LogP: 4.91; (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: 1.587; (8)Molar Refractivity: 78.21 cm3; (9)Molar Volume: 232.5 cm3; (10)Polarizability: 31×10-24 cm3; (11)Surface Tension: 41.5 dyne/cm; (12)Density: 1.303 g/cm3; (13)Flash Point: 23.2 °C; (14)Enthalpy of Vaporization: 60.61 kJ/mol; (15)Boiling Point: 360.4 °C at 760 mmHg; (16)Vapour Pressure: 2.23E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccccc1Br)c2c(cc(cc2C)C)C
(2) InChI: InChI=1/C16H15BrO/c1-10-8-11(2)15(12(3)9-10)16(18)13-6-4-5-7-14(13)17/h4-9H,1-3H3
(3) InChIKey: GBBHLKRNXLWUMF-UHFFFAOYAU