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Search term: OAHUDYBQKIUBMC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | [2-(Cyclohexylamino)ethane-1,1-Diyl]bisphosphonic Acid | C8H19NO6P2

[2-(Cyclohexylamino)ethane-1,1-Diyl]bisphosphonic Acid

  • Molecular FormulaC8H19NO6P2
  • Average mass287.187 Da
  • Monoisotopic mass287.068756 Da
  • ChemSpider ID15762709

More details:

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

[2-(Cyclohexylamino)-1,1-ethandiyl]bis(phosphonsäure) [German] [ACD/IUPAC Name]
[2-(Cyclohexylamino)-1,1-ethanediyl]bis(phosphonic acid) [ACD/IUPAC Name]
[2-(cyclohexylamino)ethane-1,1-diyl]bis(phosphonic acid)
[2-(Cyclohexylamino)ethane-1,1-Diyl]bisphosphonic Acid
Acide [2-(cyclohexylamino)-1,1-éthanediyl]bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [2-(cyclohexylamino)ethylidene]bis- [ACD/Index Name]
0MQ
1-[(cyclohexylamino)ethyl]-1,1-bisphosphonicacid
146829-50-7 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL261432/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 598.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 97.3±6.0 kJ/mol
Flash Point: 315.6±32.9 °C
Index of Refraction: 1.536
Molar Refractivity: 60.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.73
ACD/LogD (pH 5.5): -6.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 68.2±5.0 dyne/cm
Molar Volume: 193.4±5.0 cm3

Click to predict properties on the Chemicalize site


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