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CAS No.: | 137075-21-9 |
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Name: | 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE |
Article Data: | 6 |
Molecular Structure: | |
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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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