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22518-27-0

Basic Information
CAS No.: 22518-27-0
Name: 4-(4-Chlorophenyl)-2-pyrrolidinone
Article Data: 21
Molecular Structure:
Molecular Structure of 22518-27-0 (4-(4-Chlorophenyl)-2-pyrrolidinone)
Formula: C10H10ClNO
Molecular Weight: 195.648
Synonyms: 2-pyrrolidinone, 4-(4-chlorophenyl)-;4-(4-Chlorophenyl)pyrrolidin-2-one;4-(4-Chloro-phenyl)-pyrrolidin-2-one;pyrrolidin-2-one, 4-(4-chlorophenyl)-;
EINECS: 200-258-5
Density: 1.243g/cm3
Boiling Point: 390°Cat760mmHg
Flash Point: 189.6 °C
PSA: 29.10000
LogP: 2.27230
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  • 4-(4-Chlorophenyl)-2-pyrrolidinone  CAS:22518-27-0

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  • 4-(4-chlorophenyl)-2-pyrrolidinone CAS NO.22518-27-0

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Specification

The 4-(4-Chlorophenyl)-2-pyrrolidinone with the cas number 22518-27-0, is also called 4-(4-Chloro-phenyl)-pyrrolidin-2-one. The product can be supplied by the following suppliers: (1)Refine Chemicals Science and Technology Developing Co., Ltd.; (2)Beijing Smart Chemicals Co., Ltd.; (3)Link Chemicals Co.,Ltd.; (4)Hangzhou Sunny Chemical Co., Ltd.; (5)Nanjing Chemlin Chemical Co., Ltd.

The properties of the chemical are: (1)ACD/LogP: 0.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.8; (4)ACD/LogD (pH 7.4): 0.8; (5)ACD/BCF (pH 5.5): 2.37; (6)ACD/BCF (pH 7.4): 2.37; (7)ACD/KOC (pH 5.5): 64.6; (8)ACD/KOC (pH 7.4): 64.6; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.31 Å; (13)Index of Refraction: 1.565; (14)Molar Refractivity: 51.26 cm3; (15)Molar Volume: 157.3 cm3; (16)Polarizability: 20.32×10-24cm3; (17)Surface Tension: 42.9 dyne/cm; (18)Enthalpy of Vaporization:  63.94 kJ/mol ; (19)Vapour Pressure: 2.74×10-6 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)C2CC(=O)NC2
(2)InChI: InChI=1/C10H10ClNO/c11-9-3-1-7(2-4-9)8-5-10(13)12-6-8/h1-4,8H,5-6H2,(H,12,13)