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| CAS No.: | 932-28-5 |
|---|---|
| Name: | Ethanone, 2-chloro-1-cyclopentyl- (9CI) |
| Article Data: | 13 |
| Molecular Structure: | |
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| Formula: | C7H11ClO |
| Molecular Weight: | 146.617 |
| Synonyms: | Ketone,chloromethyl cyclopentyl (7CI,8CI);2-Chloro-1-cyclopentylethanone;Chloromethyl cyclopentyl ketone; |
| Density: | 1.116 g/cm3 |
| Boiling Point: | 205.1 °C at 760 mmHg |
| Flash Point: | 92.8 °C |
| PSA: | 17.07000 |
| LogP: | 1.98450 |
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Specification
The 2-Chloro-1-cyclopentylethanone, with the CAS registry number 932-28-5, is also called Ethanone, 2-chloro-1-cyclopentyl-. It belongs to the product category of Acetylhalide. And the molecular formula of the chemical is C7H11ClO.
The characteristics of this chemical are as followings: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.92; (4)ACD/LogD (pH 7.4): 1.92; (5)ACD/BCF (pH 5.5): 16.96; (6)ACD/BCF (pH 7.4): 16.96; (7)ACD/KOC (pH 5.5): 264.04; (8)ACD/KOC (pH 7.4): 264.04; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.476; (14)Molar Refractivity: 37.11 cm3; (15)Molar Volume: 131.3 cm3; (16)Polarizability: 14.71×10-24cm3; (17)Surface Tension: 36.4 dyne/cm; (18)Density: 1.116 g/cm3; (19)Flash Point: 92.8 °C; (20)Enthalpy of Vaporization: 44.14 kJ/mol; (21)Boiling Point: 205.1 °C at 760 mmHg; (22)Vapour Pressure: 0.254 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: ClCC(=O)C1CCCC1
(2)InChI: InChI=1/C7H11ClO/c8-5-7(9)6-3-1-2-4-6/h6H,1-5H2
(3)InChIKey: ZKYWWOXZNCTARW-UHFFFAOYAN