Product Name

  • Name

    Methanone,(4-methoxyphenyl)-4-piperidinyl-, hydrochloride (1:1)

  • EINECS
  • CAS No. 25519-82-8
  • Article Data2
  • CAS DataBase
  • Density
  • Solubility
  • Melting Point 260-264°C
  • Formula C13H17NO2.ClH
  • Boiling Point 371.3 °C at 760 mmHg
  • Molecular Weight 255.744
  • Flash Point 178.3 °C
  • Transport Information
  • Appearance
  • Safety 24/25
  • Risk Codes
  • Molecular Structure Molecular Structure of 25519-82-8 (Methanone,(4-methoxyphenyl)-4-piperidinyl-, hydrochloride (1:1))
  • Hazard Symbols IrritantXi
  • Synonyms Ketone,p-methoxyphenyl 4-piperidyl, hydrochloride (8CI);Methanone,(4-methoxyphenyl)-4-piperidinyl-, hydrochloride (9CI);4-(4-Methoxybenzoyl)piperidine hydrochloride;4-(p-Methoxybenzoyl)piperidinehydrochloride;
  • PSA 38.33000
  • LogP 3.00830

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

The Methanone,(4-methoxyphenyl)-4-piperidinyl-, hydrochloride (1:1), with its CAS registry number 25519-82-8, has its systematic name of (4-methoxyphenyl)(piperidin-4-yl)methanone hydrochloride . With its molecular formula of C13H17NO2.ClH and molecular weight of 255.74, it belongs to the product categories of Pyrans, Piperidines, Piperazines. Besides, it should be kept in the cool, dry and well-ventilated place. In addition, it is irritant and it should avoid contact with your eyes and skin.

Physical properties of Methanone,(4-methoxyphenyl)-4-piperidinyl-, hydrochloride (1:1): (1)ACD/LogP: 1.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.2; (4)ACD/LogD (pH 7.4): -0.72; (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; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å2; (13)Flash Point: 178.3 °C; (14)Enthalpy of Vaporization: 61.83 kJ/mol; (15)Boiling Point: 371.3 °C at 760 mmHg; (16)Vapour Pressure: 1.04E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O=C(c1ccc(OC)cc1)C2CCNCC2.Cl
(2)InChI:InChI=1/C13H17NO2.ClH/c1-16-12-4-2-10(3-5-12)13(15)11-6-8-14-9-7-11;/h2-5,11,14H,6-9H2,1H3;1H
(3)InChIKey:BBDTWYQCXXFKDH-UHFFFAOYAC

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