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Ethanone,1-(4-methyl-1-piperidinyl)-

  • Name Ethanone,1-(4-methyl-1-piperidinyl)-
  • EINECS224-984-8
  • CAS No. 4593-17-3
  • Density0.949 g/cm3
  • PSA20.31000
  • LogP1.20270
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC8H15NO
  • Boiling Point239.2 °C at 760 mmHg
  • Molecular Weight141.213
  • Flash Point101.3 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 4593-17-3 (1-acetyl-4-methylpiperidine)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data4

Ethanone,1-(4-methyl-1-piperidinyl)- Specification

The Ethanone,1-(4-methyl-1-piperidinyl)-, with the CAS registry number 4593-17-3, is also known as 3-Acetyl-5-hydroxy-2-methylbenzofuran. Its EINECS registry number is 224-984-8. This chemical's molecular formula is C8H15NO and molecular weight is 141.2108. What's more, its IUPAC name and systematic name are the same which is called 1-(4-Methylpiperidin-1-yl)ethanone.

Physical properties about Ethanone,1-(4-methyl-1-piperidinyl)-: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.22; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 110.17; (8)ACD/KOC (pH 7.4): 110.17; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 40.53 cm3; (15)Molar Volume: 148.7 cm3; (16)Surface Tension: 30.7 dyne/cm; (17)Density: 0.949 g/cm3; (18)Flash Point: 101.3 °C; (19)Enthalpy of Vaporization: 47.61 kJ/mol; (20)Boiling Point: 239.2 °C at 760 mmHg; (21)Vapour Pressure: 0.0406 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N1CCC(C)CC1)C
(2) InChI: InChI=1/C8H15NO/c1-7-3-5-9(6-4-7)8(2)10/h7H,3-6H2,1-2H3
(3) InChIKey: DWPMJTVAEDBIES-UHFFFAOYAU

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