Found 35 results

Search term: MF = 'C_{38}H_{72}NO_{8}P'
ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyl (9Z)-9-hexadecenoate | C38H72NO8P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyl (9Z)-9-hexadecenoate

  • Molecular FormulaC38H72NO8P
  • Average mass701.954 Da
  • Monoisotopic mass701.499573 Da
  • ChemSpider ID59695948

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyl (9Z)-9-hexadecenoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyl-(9Z)-9-hexadecenoat [German] [ACD/IUPAC Name]
(9Z)-9-Hexadécénoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyle [French] [ACD/IUPAC Name]
Cyclopropaneoctanoic acid, 2-hexyl-, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[[(9Z)-1-oxo-9-hexadecen-1-yl]oxy]methyl]ethyl ester [ACD/Index Name]
PE(16:1(9Z)/17:0cycw7c)

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

Density: 1.0±0.1 g/cm3
Boiling Point: 733.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 116.5±6.0 kJ/mol
Flash Point: 397.4±35.7 °C
Index of Refraction: 1.486
Molar Refractivity: 195.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 12.98
ACD/LogD (pH 5.5): 7.83
ACD/BCF (pH 5.5): 131434.84
ACD/KOC (pH 5.5): 31234.95
ACD/LogD (pH 7.4): 7.73
ACD/BCF (pH 7.4): 105888.53
ACD/KOC (pH 7.4): 25163.97
Polar Surface Area: 144 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 679.1±3.0 cm3

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