ChemSpider 2D Image | 2-Imino-4-(phosphonomethyl)heptanoic acid | C8H16NO5P

2-Imino-4-(phosphonomethyl)heptanoic acid

  • Molecular FormulaC8H16NO5P
  • Average mass237.190 Da
  • Monoisotopic mass237.076614 Da
  • ChemSpider ID34890925

More details:






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

2-Imino-4-(phosphonomethyl)heptanoic acid [ACD/IUPAC Name]
2-Imino-4-(phosphonomethyl)heptansäure [German] [ACD/IUPAC Name]
Acide 2-imino-4-(phosphonométhyl)heptanoïque [French] [ACD/IUPAC Name]
Heptanoic acid, 2-imino-4-(phosphonomethyl)- [ACD/Index Name]
CHEMBL426267

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 457.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 230.4±31.5 °C
Index of Refraction: 1.549
Molar Refractivity: 52.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.60
ACD/LogD (pH 5.5): -4.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 63.5±7.0 dyne/cm
Molar Volume: 164.2±7.0 cm3

Click to predict properties on the Chemicalize site






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