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CAS No.: | 142508-07-4 |
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Name: | (1S,2R)-2-(ISOPROPYLAMINO)-1,2-DIPHENYLETHANOL |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C17H21NO |
Molecular Weight: | 255.36 |
Synonyms: | Benzeneethanol,b-[(1-methylethyl)amino]-a-phenyl-, [S-(R*,S*)]-;(1S,2R)-2-(Isopropylamino)-1,2-diphenylethanol; |
Density: | 1.061 g/cm3 |
Boiling Point: | 378.1 °C at 760 mmHg |
Flash Point: | 98.2 °C |
PSA: | 32.26000 |
LogP: | 3.85020 |
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The Benzeneethanol, b-[(1-methylethyl)amino]-a-phenyl-, (aS, bR)-, with the CAS registry number 142508-07-4, is also known as Benzeneethanol, β-[(1-methylethyl)amino]-α-phenyl-, (αS, βR)-. This chemical's molecular formula is C17H21NO and molecular weight is 255.35. What's more, its systematic name is (1S, 2R)-1, 2-Diphenyl-2-(propan-2-ylamino)ethanol.
Physical properties about Benzeneethanol, b-[(1-methylethyl)amino]-a-phenyl-, (aS, bR)- are: (1)ACD/LogP: 3.60; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.572; (8)Molar Refractivity: 79.28 cm3; (9)Molar Volume: 240.6 cm3; (10)Polarizability: 31.42×10-24 cm3; (11)Surface Tension: 42.5 dyne/cm; (12)Density: 1.061 g/cm3; (13)Flash Point: 98.2 °C; (14)Enthalpy of Vaporization: 66.03 kJ/mol; (15)Boiling Point: 378.1 °C at 760 mmHg; (16)Vapour Pressure: 2.17E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O[C@@H](c1ccccc1)[C@@H](c2ccccc2)NC(C)C
(2) InChI: InChI=1/C17H21NO/c1-13(2)18-16(14-9-5-3-6-10-14)17(19)15-11-7-4-8-12-15/h3-13,16-19H,1-2H3/t16-,17+/m1/s1
(3) InChIKey: ILABSMRKFLZNPK-SJORKVTEBI