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110480-86-9

Basic Information
CAS No.: 110480-86-9
Name: (1S)-1-Amino-2-methyl-1-phenylpropan-2-ol
Article Data: 13
Molecular Structure:
Molecular Structure of 110480-86-9 ((1S)-1-Amino-2-methyl-1-phenylpropan-2-ol)
Formula: C10H15NO
Molecular Weight: 165.235
Synonyms: (1S)-1-Amino-2-methyl-1-phenylpropan-2-ol
Density: 1.05 g/cm3
Melting Point: 47-50℃
Boiling Point: 295 °C at 760 mmHg
Flash Point: 132.2 °C
PSA: 46.25000
LogP: 2.15760
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Specification

The (1S)-1-Amino-2-methyl-1-phenylpropan-2-ol, with the CAS registry number 110480-86-9, has the systematic name of 1-amino-2-methyl-1-phenylpropan-2-ol. And the molecular formula of the chemical is C10H15NO.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.11; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.55; (8)Molar Refractivity: 50.1 cm3; (9)Molar Volume: 157.2 cm3; (10)Polarizability: 19.86×10-24cm3; (11)Surface Tension: 43.1 dyne/cm; (12)Density: 1.05 g/cm3; (13)Flash Point: 132.2 °C; (14)Enthalpy of Vaporization: 56.47 kJ/mol; (15)Boiling Point: 295 °C at 760 mmHg; (16)Vapour Pressure: 0.000709 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OC(C(N)c1ccccc1)(C)C
(2)InChI: InChI=1/C10H15NO/c1-10(2,12)9(11)8-6-4-3-5-7-8/h3-7,9,12H,11H2,1-2H3
(3)InChIKey: FAKPSIGKWYUNJZ-UHFFFAOYAG