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6442-08-6

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Basic Information
CAS No.: 6442-08-6
Name: 4,4'-Diamino-3,3'-dimethyl diphenyl cyclohexane
Article Data: 2
Molecular Structure:
Molecular Structure of 6442-08-6 (4,4'-Diamino-3,3'-dimethyl diphenyl cyclohexane)
Formula: C20H26N2
Molecular Weight: 294.44
Synonyms: o-Toluidine,4,4'-cyclohexylidenedi- (8CI);
Density: 1.089 g/cm3
Boiling Point: 463.6 °C at 760 mmHg
Flash Point: 281.1 °C
PSA: 52.04000
LogP: 5.88040
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Specification

The 4,4'-Cyclohexylidenedi-o-toluidine, with the CAS registry number 6442-08-6, is also known as Benzenamine, 4,4'-cyclohexylidenebis[2-methyl-. This chemical's molecular formula is C20H26N2 and molecular weight is 294.43384. Its systematic name is called 4,4'-cyclohexane-1,1-diylbis(2-methylaniline). 

Physical properties of 4,4'-Cyclohexylidenedi-o-toluidine: (1)ACD/LogP: 4.36; (2)ACD/LogD (pH 5.5): 4.17; (3)ACD/LogD (pH 7.4): 4.36; (4)ACD/BCF (pH 5.5): 786.04; (5)ACD/BCF (pH 7.4): 1212.57; (6)ACD/KOC (pH 5.5): 3629.88; (7)ACD/KOC (pH 7.4): 5599.54; (8)#H bond acceptors: 2; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.616; (12)Molar Refractivity: 94.58 cm3; (13)Molar Volume: 270.3 cm3; (14)Surface Tension: 49.8 dyne/cm; (15)Density: 1.089 g/cm3; (16)Flash Point: 281.1 °C; (17)Enthalpy of Vaporization: 72.48 kJ/mol; (18)Boiling Point: 463.6 °C at 760 mmHg; (19)Vapour Pressure: 9E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1(cc(ccc1N)C3(c2ccc(N)c(c2)C)CCCCC3)C
(2)InChI: InChI=1/C20H26N2/c1-14-12-16(6-8-18(14)21)20(10-4-3-5-11-20)17-7-9-19(22)15(2)13-17/h6-9,12-13H,3-5,10-11,21-22H2,1-2H3
(3)InChIKey: CGEPGDQNCRDJHS-UHFFFAOYAC