-
Name
2-CHLORO-1-PIPERIDIN-1-YL-ETHANONE
- EINECS
- CAS No. 1440-60-4
- Article Data58
- CAS DataBase
- Density 1.153 g/cm3
- Solubility
- Melting Point
- Formula C7H12ClNO
- Boiling Point 270.3 °C at 760 mmHg
- Molecular Weight 161.631
- Flash Point 117.3 °C
- Transport Information
- Appearance clear pale yellow liquid
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Piperidine,1-(chloroacetyl)- (6CI,7CI,8CI,9CI);1-(2-Chloroacetyl)piperidine;1-(Chloroacetyl)piperidine;2-Chloro-1-(piperidin-1-yl)ethanone;Chloroaceticacid piperidine amide;N-(Chloroacetyl)piperidine;NSC 8198;a-Chloroacetopiperidide;
- PSA 20.31000
- LogP 1.17560
Ethanone,2-chloro-1-(1-piperidinyl)- Specification
The Ethanone,2-chloro-1-(1-piperidinyl)-, with the CAS registry number 1440-60-4, is also known as 1-(Chloroacetyl)piperidine. It belongs to the product categories of Acetylhalide; Piperidine. This chemical's molecular formula is C7H12ClNO and molecular weight is 161.62928. Its IUPAC name is called 2-chloro-1-piperidin-1-ylethanone.
Physical properties of Ethanone,2-chloro-1-(1-piperidinyl)-: (1)ACD/LogP: 0.96; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 1; (4)Index of Refraction: 1.492; (5)Molar Refractivity: 40.67 cm3; (6)Molar Volume: 140.1 cm3; (7)Surface Tension: 39.4 dyne/cm; (8)Density: 1.153 g/cm3; (9)Flash Point: 117.3 °C; (10)Enthalpy of Vaporization: 50.85 kJ/mol; (11)Boiling Point: 270.3 °C at 760 mmHg; (12)Vapour Pressure: 0.00689 mmHg at 25°C.
Preparation: this chemical can be prepared by piperidine and chloroacetyl chloride. This reaction will need reagent diethyl ether.
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Uses of Ethanone,2-chloro-1-(1-piperidinyl)-: it can be used to produce 1-(morpholin-4-yl-acetyl)-piperidine at ambient temperature. This reaction will need solvent H2O and acetonitrile. The yield is about 71%.
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You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCN(CC1)C(=O)CCl
(2)InChI: InChI=1S/C7H12ClNO/c8-6-7(10)9-4-2-1-3-5-9/h1-6H2
(3)InChIKey: NSWLMOHUXYULKL-UHFFFAOYSA-N
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