ChemSpider 2D Image | 2-[(2-Chlorobenzyl)sulfanyl]-1-(1-oxa-8-azaspiro[4.5]dec-8-yl)ethanone | C17H22ClNO2S

2-[(2-Chlorobenzyl)sulfanyl]-1-(1-oxa-8-azaspiro[4.5]dec-8-yl)ethanone

  • Molecular FormulaC17H22ClNO2S
  • Average mass339.880 Da
  • Monoisotopic mass339.105988 Da
  • ChemSpider ID29616631

More details:

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

2-[(2-Chlorbenzyl)sulfanyl]-1-(1-oxa-8-azaspiro[4.5]dec-8-yl)ethanon [German] [ACD/IUPAC Name]
2-[(2-Chlorobenzyl)sulfanyl]-1-(1-oxa-8-azaspiro[4.5]dec-8-yl)ethanone [ACD/IUPAC Name]
2-[(2-Chlorobenzyl)sulfanyl]-1-(1-oxa-8-azaspiro[4.5]déc-8-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[[(2-chlorophenyl)methyl]thio]-1-(1-oxa-8-azaspiro[4.5]dec-8-yl)- [ACD/Index Name]
2-{[(2-CHLOROPHENYL)METHYL]SULFANYL}-1-{1-OXA-8-AZASPIRO[4.5]DECAN-8-YL}ETHAN-1-ONE
2-{[(2-CHLOROPHENYL)METHYL]SULFANYL}-1-{1-OXA-8-AZASPIRO[4.5]DECAN-8-YL}ETHANONE
8-{[(2-chlorobenzyl)thio]acetyl}-1-oxa-8-azaspiro[4.5]decane

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

Density: 1.3±0.1 g/cm3
Boiling Point: 504.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 258.7±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 92.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 349.78
ACD/KOC (pH 5.5): 2303.84
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 349.78
ACD/KOC (pH 7.4): 2303.84
Polar Surface Area: 55 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 267.8±5.0 cm3

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