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42291-10-1

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Basic Information
CAS No.: 42291-10-1
Name: (S)-(-)-1,2,2-TRIPHENYLETHYLAMINE
Article Data: 8
Molecular Structure:
Molecular Structure of 42291-10-1 ((S)-(-)-1,2,2-TRIPHENYLETHYLAMINE)
Formula: C20H19N
Molecular Weight: 273.37
Synonyms: 1,2,2-Triphenylethylamine;(S)-1,2,2-Triphenylethanamine;Ethylamine,1,2,2-triphenyl- (6CI,7CI);(S)-(-)-1,2,2-Triphenylethylamine;
Density: 1.088 g/cm3
Melting Point: 66-69 °C(lit.)
Boiling Point: 380.2 °C at 760 mmHg
Flash Point: 174.6 °C
PSA: 26.02000
LogP: 5.21880
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Specification

The CAS register number of Benzeneethanamine, a,b-diphenyl- is 42291-10-1. It also can be called as 1,2,2-Triphenylethylamine and the systematic name about this chemical is (1S)-1,2,2-triphenylethanamine. The molecular formula about this chemical is C20H19N and the molecular weight is 273.37.

Physical properties about Benzeneethanamine, a,b-diphenyl- are: (1)ACD/LogP: 4.77; (2)ACD/LogD (pH 5.5): 1.82; (3)ACD/LogD (pH 7.4): 3.19; (4)ACD/BCF (pH 5.5): 2.79; (5)ACD/BCF (pH 7.4): 66.14; (6)ACD/KOC (pH 5.5): 10.55; (7)ACD/KOC (pH 7.4): 249.84; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 26.02 Å2; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 88.22 cm3; (14)Molar Volume: 251.2 cm3; (15)Polarizability: 34.97x10-24cm3; (16)Surface Tension: 46.6 dyne/cm; (17)Density: 1.088 g/cm3; (18)Flash Point: 174.6 °C; (19)Enthalpy of Vaporization: 62.84 kJ/mol; (20)Boiling Point: 380.2 °C at 760 mmHg; (21)Vapour Pressure: 5.53E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: N[C@@H](C(c1ccccc1)c2ccccc2)c3ccccc3
(2)InChI: InChI=1/C20H19N/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19-20H,21H2/t20-/m1/s1
(3)InChIKey: NDCGGZYGIWLSAT-HXUWFJFHBJ
(4)Std. InChI: InChI=1S/C20H19N/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19-20H,21H2/t20-/m1/s1
(5)Std. InChIKey: NDCGGZYGIWLSAT-HXUWFJFHSA-N