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Search term: C9H16O3S (Found by molecular formula)

ChemSpider 2D Image | 3-Hydroxy-1-[(2-methyl-2-propanyl)sulfanyl]cyclobutanecarboxylic acid | C9H16O3S

3-Hydroxy-1-[(2-methyl-2-propanyl)sulfanyl]cyclobutanecarboxylic acid

  • Molecular FormulaC9H16O3S
  • Average mass204.286 Da
  • Monoisotopic mass204.082016 Da
  • ChemSpider ID65334379

More details:






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

3-Hydroxy-1-[(2-methyl-2-propanyl)sulfanyl]cyclobutancarbonsäure [German] [ACD/IUPAC Name]
3-Hydroxy-1-[(2-methyl-2-propanyl)sulfanyl]cyclobutanecarboxylic acid [ACD/IUPAC Name]
Acide 3-hydroxy-1-[(2-méthyl-2-propanyl)sulfanyl]cyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 1-[(1,1-dimethylethyl)thio]-3-hydroxy- [ACD/Index Name]
1-(tert-butylsulfanyl)-3-hydroxycyclobutane-1-carboxylic acid
1497086-23-3 [RN]
MFCD21659959

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

Density: 1.2±0.1 g/cm3
Boiling Point: 358.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 69.9±6.0 kJ/mol
Flash Point: 170.4±27.9 °C
Index of Refraction: 1.547
Molar Refractivity: 52.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.28
ACD/LogD (pH 7.4): -2.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 166.6±5.0 cm3

Click to predict properties on the Chemicalize site






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