ChemSpider 2D Image | S-[2-(Diisopropylamino)ethyl] O-ethyl (R)-methylphosphonothioate | C11H26NO2PS

S-[2-(Diisopropylamino)ethyl] O-ethyl (R)-methylphosphonothioate

  • Molecular FormulaC11H26NO2PS
  • Average mass267.368 Da
  • Monoisotopic mass267.142181 Da
  • ChemSpider ID34988475

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-Méthylphosphonothioate de S-[2-(diisopropylamino)éthyle] et de O-éthyle [French] [ACD/IUPAC Name]
Phosphonothioic acid, P-[(1R)-methyl]-, S-[2-[bis(1-methylethyl)amino]ethyl] O-ethyl ester, (R)- [ACD/Index Name]
S-[2-(Diisopropylamino)ethyl] O-ethyl (R)-methylphosphonothioate [ACD/IUPAC Name]
S-[2-(Diisopropylamino)ethyl]-O-ethyl-(R)-methylphosphonothioat [German] [ACD/IUPAC Name]
(R)-S-(2-(Bis(1-methylethyl)amino)ethyl) O-ethyl methylphosphonothioate
50782-69-9 [RN]
O-ETHYL S-2-DIISOPROPYLAMINOETHYL METHYLPHOSPHONOTHIOATE
UNII-9A4381183B

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

Density: 1.0±0.1 g/cm3
Boiling Point: 318.8±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.0±3.0 kJ/mol
Flash Point: 146.6±28.4 °C
Index of Refraction: 1.470
Molar Refractivity: 73.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): -1.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.23
Polar Surface Area: 65 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 262.6±3.0 cm3

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