ChemSpider 2D Image | (Hydroxy{[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]oxy}phosphoryl)acetic acid | C17H29O5P

(Hydroxy{[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]oxy}phosphoryl)acetic acid

  • Molecular FormulaC17H29O5P
  • Average mass344.383 Da
  • Monoisotopic mass344.175262 Da
  • ChemSpider ID25063686

  • Double-bond stereo - Double-bond stereo

More details:

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

(Hydroxy{[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]oxy}phosphoryl)acetic acid [ACD/IUPAC Name]
(Hydroxy{[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]oxy}phosphoryl)essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[hydroxy[[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]oxy]phosphinyl]- [ACD/Index Name]
Acide (hydroxy{[(2E,6E)-3,7,11-triméthyl-2,6,10-dodécatrién-1-yl]oxy}phosphoryl)acétique [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL1204457/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 502.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 84.4±6.0 kJ/mol
Flash Point: 257.6±32.9 °C
Index of Refraction: 1.503
Molar Refractivity: 92.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 312.0±3.0 cm3

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