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91361-07-8

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Basic Information
CAS No.: 91361-07-8
Name: (1S,2S)-N,N,N',N'-Tetramethyl-1,2-diphenylethane-1,2-diamine
Article Data: 10
Molecular Structure:
Molecular Structure of 91361-07-8 ((1S,2S)-N,N,N',N'-Tetramethyl-1,2-diphenylethane-1,2-diamine)
Formula: C18H24N2
Molecular Weight: 268.402
Synonyms: 1,2-Ethanediamine,N,N,N',N'-tetramethyl-1,2-diphenyl-, (1S,2S)- (9CI);1,2-Ethanediamine, N,N,N',N'-tetramethyl-1,2-diphenyl-,[S-(R*,R*)]-;
Density: 1.012 g/cm3
Boiling Point: 328.6 °C at 760 mmHg
Flash Point: 138.3 °C
PSA: 6.48000
LogP: 3.59220
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Specification

The (1S,2S)-N,N,N',N'-Tetramethyl-1,2-diphenylethane-1,2-diamine, with CAS registry number 91361-07-8, has the systematic name of (1S,2S)-N,N,N',N'-tetramethyl-1,2-diphenyl-ethane-1,2-diamine. Besides this, it is also called 1,2-ethanediamine, N1,N1,N2,N2-tetramethyl-1,2-diphenyl-, (1S,2S)-. And the chemical formula of this chemical is C18H24N2.

Physical properties of (1S,2S)-N,N,N',N'-Tetramethyl-1,2-diphenylethane-1,2-diamine: (1)ACD/LogP: 4.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.15; (4)ACD/LogD (pH 7.4): 3.8; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: Å2; (9)Index of Refraction: 1.564; (10)Molar Refractivity: 86.26 cm3; (11)Molar Volume: 264.9 cm3; (12)Polarizability: 34.19×10-24cm3; (13)Surface Tension: 39.3 dyne/cm; (14)Enthalpy of Vaporization: 57.1 kJ/mol; (15)Vapour Pressure: 0.000188 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CN(C)C(c1ccccc1)C(c2ccccc2)N(C)C
(2)InChI: InChI=1/C18H24N2/c1-19(2)17(15-11-7-5-8-12-15)18(20(3)4)16-13-9-6-10-14-16/h5-14,17-18H,1-4H3/t17-,18-/m0/s1
(3)InChIKey: MYLJZKKJRGGLPH-ROUUACIJBC
(4)Std. InChI: InChI=1S/C18H24N2/c1-19(2)17(15-11-7-5-8-12-15)18(20(3)4)16-13-9-6-10-14-16/h5-14,17-18H,1-4H3/t17-,18-/m0/s1
(5)Std. InChIKey: MYLJZKKJRGGLPH-ROUUACIJSA-N