Found 38 results

Search term: MF = 'C_{12}H_{16}NO_{3}P'
ChemSpider 2D Image | {4-[3-(Methylamino)-1-butyn-1-yl]benzyl}phosphonic acid | C12H16NO3P

{4-[3-(Methylamino)-1-butyn-1-yl]benzyl}phosphonic acid

  • Molecular FormulaC12H16NO3P
  • Average mass253.234 Da
  • Monoisotopic mass253.086777 Da
  • ChemSpider ID83538667

More details:

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

{4-[3-(Methylamino)-1-butin-1-yl]benzyl}phosphonsäure [German] [ACD/IUPAC Name]
{4-[3-(Methylamino)-1-butyn-1-yl]benzyl}phosphonic acid [ACD/IUPAC Name]
Acide {4-[3-(méthylamino)-1-butyn-1-yl]benzyl}phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [[4-[3-(methylamino)-1-butyn-1-yl]phenyl]methyl]- [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: 455.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 229.4±31.5 °C
Index of Refraction: 1.571
Molar Refractivity: 66.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.50
ACD/LogD (pH 5.5): -2.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 79 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 56.7±5.0 dyne/cm
Molar Volume: 200.8±5.0 cm3

Click to predict properties on the Chemicalize site


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