ChemSpider 2D Image | [2-(Heptylamino)-1,1-ethanediyl]bis(phosphonic acid) | C9H23NO6P2

[2-(Heptylamino)-1,1-ethanediyl]bis(phosphonic acid)

  • Molecular FormulaC9H23NO6P2
  • Average mass303.229 Da
  • Monoisotopic mass303.100067 Da
  • ChemSpider ID22485080

More details:

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

[2-(Heptylamino)-1,1-ethandiyl]bis(phosphonsäure) [German] [ACD/IUPAC Name]
[2-(Heptylamino)-1,1-ethanediyl]bis(phosphonic acid) [ACD/IUPAC Name]
[2-(heptylamino)ethane-1,1-diyl]bis(phosphonic acid)
Acide [2-(heptylamino)-1,1-éthanediyl]bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [2-(heptylamino)ethylidene]bis- [ACD/Index Name]
(2-heptylamino-1-phosphono-ethyl)-phosphonic acid
0M8
1-[(n-hept-1-ylamino)ethyl]-1,1-bisphosphonic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL261473/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 555.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 91.5±6.0 kJ/mol
Flash Point: 289.6±32.9 °C
Index of Refraction: 1.510
Molar Refractivity: 67.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -0.60
ACD/LogD (pH 5.5): -4.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 60.6±3.0 dyne/cm
Molar Volume: 224.6±3.0 cm3

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