Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1) supplier

Name
(4-CHLOROPHENYL)(4-PIPERIDYL)METHANONE HYDROCHLORIDE
EINECS
CAS No. 55695-51-7
Article Data1
CAS DataBase
Density
Solubility
Melting Point 238-239 °C
Formula C₁₂H₁₅Cl₂NO
Boiling Point 356.2 °C at 760 mmHg
Molecular Weight 260.163
Flash Point 169.2 °C
Transport Information
Appearance Off-White Solid
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (9CI);(4-Chlorophenyl)(piperidin-4-yl)methanonehydrochloride;4-(4-Chlorobenzoyl)piperidine hydrochloride;(4-Chlorophenyl)-4-piperidinyl-methanone, hydrochloride;Buttpark 99\50-18;
PSA 29.10000
LogP 3.65310

Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1) Specification

The Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1), with the CAS registry number 55695-51-7, is also known as 4-(p-Chlorobenzoyl)piperidine hydrochloride. It belongs to the product category of Aromatics. This chemical's molecular formula is C₁₂H₁₅Cl₂NO and molecular weight is 260.16. What's more, its systematic name is (4-Chlorophenyl)(piperidin-4-yl)methanone hydrochloride. The product should be sealed and stored in containers which are placed in cool, ventilated and dry places.

Physical properties of Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1) are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.59; (4)ACD/LogD (pH 7.4): -0.02; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.64; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31 Å²; (13)Flash Point: 169.2 °C; (14)Enthalpy of Vaporization: 60.15 kJ/mol; (15)Boiling Point: 356.2 °C at 760 mmHg; (16)Vapour Pressure: 2.96E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(Cl)cc1)C2CCNCC2.Cl
(2)InChI: InChI=1S/C12H14ClNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H
(3)InChIKey: LZUYKOBTHSPKED-UHFFFAOYSA-N

Product Name

(4-CHLOROPHENYL)(4-PIPERIDYL)METHANONE HYDROCHLORIDE

Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1) Specification

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