ChemSpider 2D Image | (2R)-1-Phenoxy-2-butanyl (R)-methylphosphonochloridate | C11H16ClO3P

(2R)-1-Phenoxy-2-butanyl (R)-methylphosphonochloridate

  • Molecular FormulaC11H16ClO3P
  • Average mass262.670 Da
  • Monoisotopic mass262.052551 Da
  • ChemSpider ID25057839

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R)-1-Phenoxy-2-butanyl (R)-methylphosphonochloridate [ACD/IUPAC Name]
(2R)-1-Phenoxy-2-butanyl-(R)-methylphosphonochloridat [German] [ACD/IUPAC Name]
(R)-Méthylphosphonochloridate de (2R)-1-phénoxy-2-butanyle [French] [ACD/IUPAC Name]
(RP,SP)-O-(2R)-(1-PHENOXYBUT-2-YL)-METHYLPHOSPHONIC ACID CHLORIDE
Phosphonochloridic acid, P-[(1R)-methyl]-, (1R)-1-(phenoxymethyl)propyl ester, (R)- [ACD/Index Name]
(R)-((2R)-1-phenoxybutan-2-yl chloro(methyl)phosphinate)

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

Density: 1.2±0.1 g/cm3
Boiling Point: 345.6±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 233.0±36.1 °C
Index of Refraction: 1.497
Molar Refractivity: 64.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.05
ACD/KOC (pH 5.5): 556.40
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.05
ACD/KOC (pH 7.4): 556.40
Polar Surface Area: 45 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 221.7±3.0 cm3

Click to predict properties on the Chemicalize site


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