Found 38 results

Search term: MF = 'C_{12}H_{16}NO_{3}P'
ChemSpider 2D Image | Dimethyl (1-cyano-2-phenylpropyl)phosphonate | C12H16NO3P

Dimethyl (1-cyano-2-phenylpropyl)phosphonate

  • Molecular FormulaC12H16NO3P
  • Average mass253.234 Da
  • Monoisotopic mass253.086777 Da
  • ChemSpider ID21418895

More details:

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

(1-Cyano-2-phénylpropyl)phosphonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl (1-cyano-2-phenylpropyl)phosphonate [ACD/IUPAC Name]
Dimethyl-(1-cyan-2-phenylpropyl)phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-(1-cyano-2-phenylpropyl)-, dimethyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 383.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 185.8±25.9 °C
Index of Refraction: 1.500
Molar Refractivity: 64.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 4.96
ACD/KOC (pH 5.5): 109.46
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.96
ACD/KOC (pH 7.4): 109.46
Polar Surface Area: 69 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 219.7±3.0 cm3

Click to predict properties on the Chemicalize site


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