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1712-87-4

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Basic Information
CAS No.: 1712-87-4
Name: m-Toluoyl and benzoyl peroxide
Article Data: 10
Molecular Structure:
Molecular Structure of 1712-87-4 (m-Toluoyl and benzoyl peroxide)
Formula: C16H14O4
Molecular Weight: 270.285
Synonyms: m-Toluoylperoxide (7CI,8CI);Bis(3-methylbenzoyl) peroxide;Nyper MT;Nyper MT 80;m,m'-Dimethyldibenzoyl peroxide;m-Methylbenzoyl peroxide;
Density: 1.198 g/cm3
Boiling Point: 404.508 °C at 760 mmHg
Flash Point: 179.191 °C
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Specification

The Peroxide,bis(3-methylbenzoyl) is an organic compound with the formula C16H14O4. The IUPAC name of this chemical is (3-Methylbenzoyl) 3-methylbenzenecarboperoxoate. With the CAS registry number 1712-87-4, it is also named as Bis(3-methylphenyl)peroxyanhydride. Besides, its molecular weight is 270.28.

Physical properties about Peroxide,bis(3-methylbenzoyl) are: (1)ACD/LogP: 3.78; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 1285; (5)ACD/BCF (pH 7.4): 1285; (6)ACD/KOC (pH 5.5): 5847; (7)ACD/KOC (pH 7.4): 5847; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 52.6 Å2; (11)Index of Refraction: 1.573; (12)Molar Refractivity: 74.387 cm3; (13)Molar Volume: 225.654 cm3; (14)Polarizability: 29.489×10-24 cm3; (15)Surface Tension: 46.045 dyne/cm; (16)Density: 1.198 g/cm3; (17)Flash Point: 179.191 °C; (18)Enthalpy of Vaporization: 65.596 kJ/mol; (19)Boiling Point: 404.508 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C16H14O4/c1-11-5-3-7-13(9-11)15(17)19-20-16(18)14-8-4-6-12(2)10-14/h3-10H,1-2H3
(2)InChIKey: NLBJAOHLJABDAU-UHFFFAOYAU
(3)Std. InChI: InChI=1S/C16H14O4/c1-11-5-3-7-13(9-11)15(17)19-20-16(18)14-8-4-6-12(2)10-14/h3-10H,1-2H3
(4)Std. InChIKey: NLBJAOHLJABDAU-UHFFFAOYSA-N