Found 4 results

Search term: MF = 'C_{12}H_{25}S'
ChemSpider 2D Image | 2,4,4,6,6-Pentamethyl-2-heptanethiolate | C12H25S

2,4,4,6,6-Pentamethyl-2-heptanethiolate

  • Molecular FormulaC12H25S
  • Average mass201.392 Da
  • Monoisotopic mass201.168243 Da
  • ChemSpider ID95732165

  • Charge - Charge

More details:

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

2,4,4,6,6-Pentamethyl-2-heptanethiolate [ACD/IUPAC Name]
2,4,4,6,6-Pentaméthyl-2-heptanethiolate [French] [ACD/IUPAC Name]
2,4,4,6,6-Pentamethyl-2-heptanthiolat [German] [ACD/IUPAC Name]
2-Heptanethiol, 2,4,4,6,6-pentamethyl-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 218.8±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.7±3.0 kJ/mol
Flash Point: 72.6±18.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.46
ACD/LogD (pH 5.5): 5.37
ACD/BCF (pH 5.5): 7137.68
ACD/KOC (pH 5.5): 19951.10
ACD/LogD (pH 7.4): 5.37
ACD/BCF (pH 7.4): 7136.94
ACD/KOC (pH 7.4): 19949.02
Polar Surface Area: 0 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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