Found 67 results

Search term: MF = 'C_{15}H_{18}O_{3}S_{2}'
ChemSpider 2D Image | 4-(6-Oxa-2-thiaspiro[4.5]dec-9-ylsulfanyl)benzoic acid | C15H18O3S2

4-(6-Oxa-2-thiaspiro[4.5]dec-9-ylsulfanyl)benzoic acid

  • Molecular FormulaC15H18O3S2
  • Average mass310.432 Da
  • Monoisotopic mass310.069733 Da
  • ChemSpider ID35699726

More details:

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

4-(6-Oxa-2-thiaspiro[4.5]dec-9-ylsulfanyl)benzoesäure [German] [ACD/IUPAC Name]
4-(6-Oxa-2-thiaspiro[4.5]dec-9-ylsulfanyl)benzoic acid [ACD/IUPAC Name]
Acide 4-(6-oxa-2-thiaspiro[4.5]déc-9-ylsulfanyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(6-oxa-2-thiaspiro[4.5]dec-9-ylthio)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 524.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 84.1±3.0 kJ/mol
Flash Point: 271.0±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 83.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 24.43
ACD/KOC (pH 5.5): 136.90
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.21
Polar Surface Area: 97 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 62.5±5.0 dyne/cm
Molar Volume: 229.4±5.0 cm3

Click to predict properties on the Chemicalize site


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