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137075-21-9

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Basic Information
CAS No.: 137075-21-9
Name: 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE
Article Data: 6
Molecular Structure:
Molecular Structure of 137075-21-9 (2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE)
Formula: C17H18ClNO
Molecular Weight: 287.789
Synonyms: 2-Chloro-N-(3,3-diphenylpropyl)acetamide;2-chloro-N-(3,3-diphenylpropyl)acetamide;
Density: 1.137 g/cm3
Boiling Point: 479.1 °C at 760 mmHg
Flash Point: 243.5 °C
PSA: 32.59000
LogP: 4.40390
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Specification

The Acetamide,2-chloro-N-(3,3-diphenylpropyl)-, with the CAS registry number 137075-21-9, has the systematic name of 2-chloro-N-(3,3-diphenylpropyl)acetamide. It should be stored in the dry and cool environment. And the molecular formula of this chemical is C17H18ClNO.

The physical properties of Acetamide,2-chloro-N-(3,3-diphenylpropyl)- are as following: (1)ACD/LogP: 3.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.32; (4)ACD/LogD (pH 7.4): 3.32; (5)ACD/BCF (pH 5.5): 196.46; (6)ACD/BCF (pH 7.4): 196.46; (7)ACD/KOC (pH 5.5): 1524.53; (8)ACD/KOC (pH 7.4): 1524.53; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.566; (14)Molar Refractivity: 82.57 cm3; (15)Molar Volume: 252.9 cm3; (16)Polarizability: 32.73×10-24cm3; (17)Surface Tension: 42.9 dyne/cm; (18)Density: 1.137 g/cm3; (19)Flash Point: 243.5 °C; (20)Enthalpy of Vaporization: 74.33 kJ/mol; (21)Boiling Point: 479.1 °C at 760 mmHg; (22)Vapour Pressure: 2.44E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCC(=O)NCCC(c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C17H18ClNO/c18-13-17(20)19-12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,19,20)
(3)InChIKey: DSZCDKTVMBGLGD-UHFFFAOYAD