ChemSpider 2D Image | (2S)-3-(2-Chloroethyl)-N-[2-chloro(2,2-~2~H_2_)ethyl](6,6-~2~H_2_)-1,3,2-oxazaphosphinan-2-amine 2-oxide | C7H11D4Cl2N2O2P

(2S)-3-(2-Chloroethyl)-N-[2-chloro(2,2-2H2)ethyl](6,6-2H2)-1,3,2-oxazaphosphinan-2-amine 2-oxide

  • Molecular FormulaC7H11D4Cl2N2O2P
  • Average mass265.111 Da
  • Monoisotopic mass264.049927 Da
  • ChemSpider ID8834676

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S) 2-Oxyde de 3-(2-chloroéthyl)-N-[2-chloro(2,2-2H2)éthyl](6,6-2H2)-1,3,2-oxazaphosphinan-2-amine [French] [ACD/IUPAC Name]
(2S)-3-(2-Chlorethyl)-N-[2-chlor(2,2-2H2)ethyl](6,6-2H2)-1,3,2-oxazaphosphinan-2-amin-2-oxid [German] [ACD/IUPAC Name]
(2S)-3-(2-Chloroethyl)-N-[2-chloro(2,2-2H2)ethyl](6,6-2H2)-1,3,2-oxazaphosphinan-2-amine 2-oxide [ACD/IUPAC Name]
2H-1,3,2-Oxazaphosphorin-6-d-2-amine, 3-(2-chloroethyl)-N-(2-chloroethyl-2,2-d2)tetrahydro-6-d-, 2-oxide, (2S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 336.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.9±3.0 kJ/mol
Flash Point: 157.1±30.7 °C
Index of Refraction: 1.506
Molar Refractivity: 58.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.23
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.92
ACD/KOC (pH 5.5): 55.52
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.92
ACD/KOC (pH 7.4): 55.53
Polar Surface Area: 51 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 44.3±5.0 dyne/cm
Molar Volume: 195.7±5.0 cm3

Click to predict properties on the Chemicalize site


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