Found 40 results

Search term: MF = 'C_{20}H_{29}NO_{2}S_{2}'
ChemSpider 2D Image | 1-Benzyl-4-piperidinyl 5-(1,2-dithiolan-3-yl)pentanoate | C20H29NO2S2

1-Benzyl-4-piperidinyl 5-(1,2-dithiolan-3-yl)pentanoate

  • Molecular FormulaC20H29NO2S2
  • Average mass379.580 Da
  • Monoisotopic mass379.163971 Da
  • ChemSpider ID29412884

More details:

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

1,2-Dithiolane-3-pentanoic acid, 1-(phenylmethyl)-4-piperidinyl ester [ACD/Index Name]
1-Benzyl-4-piperidinyl 5-(1,2-dithiolan-3-yl)pentanoate [ACD/IUPAC Name]
1-Benzyl-4-piperidinyl-5-(1,2-dithiolan-3-yl)pentanoat [German] [ACD/IUPAC Name]
5-(1,2-Dithiolan-3-yl)pentanoate de 1-benzyl-4-pipéridinyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 485.2±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.3±26.8 °C
Index of Refraction: 1.598
Molar Refractivity: 109.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 52.82
ACD/KOC (pH 5.5): 188.52
ACD/LogD (pH 7.4): 4.64
ACD/BCF (pH 7.4): 1736.00
ACD/KOC (pH 7.4): 6195.87
Polar Surface Area: 80 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 320.2±5.0 cm3

Click to predict properties on the Chemicalize site


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