Found 259 results

Search term: MF = 'C_{20}H_{29}NO_{2}S'
ChemSpider 2D Image | 1-{4-[(Benzyloxy)methyl]-1-piperidinyl}-2-(cyclopentylsulfanyl)ethanone | C20H29NO2S

1-{4-[(Benzyloxy)methyl]-1-piperidinyl}-2-(cyclopentylsulfanyl)ethanone

  • Molecular FormulaC20H29NO2S
  • Average mass347.515 Da
  • Monoisotopic mass347.191895 Da
  • ChemSpider ID26302404

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-{4-[(Benzyloxy)methyl]-1-piperidinyl}-2-(cyclopentylsulfanyl)ethanon [German] [ACD/IUPAC Name]
1-{4-[(Benzyloxy)methyl]-1-piperidinyl}-2-(cyclopentylsulfanyl)ethanone [ACD/IUPAC Name]
1-{4-[(Benzyloxy)méthyl]-1-pipéridinyl}-2-(cyclopentylsulfanyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(cyclopentylthio)-1-[4-[(phenylmethoxy)methyl]-1-piperidinyl]- [ACD/Index Name]
1-(4-((benzyloxy)methyl)piperidin-1-yl)-2-(cyclopentylthio)ethanone
1226431-87-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 500.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.5±24.6 °C
Index of Refraction: 1.575
Molar Refractivity: 101.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1054.17
ACD/KOC (pH 5.5): 5074.55
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1054.17
ACD/KOC (pH 7.4): 5074.55
Polar Surface Area: 55 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 306.3±5.0 cm3

Click to predict properties on the Chemicalize site


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