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Search term: 35516697 (Found by CSID)
ChemSpider 2D Image | (3R,8aS)-5-Propyl-3-(tridecyloxy)-8,8a-dihydro-1H,6H-furo[3,4-e][1,3,2]dioxaphosphepin-6-one 3-oxide | C22H39O6P

(3R,8aS)-5-Propyl-3-(tridecyloxy)-8,8a-dihydro-1H,6H-furo[3,4-e][1,3,2]dioxaphosphepin-6-one 3-oxide

  • Molecular FormulaC22H39O6P
  • Average mass430.515 Da
  • Monoisotopic mass430.248413 Da
  • ChemSpider ID35516697

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,8aS) 3-Oxyde de 5-propyl-3-(tridécyloxy)-8,8a-dihydro-1H,6H-furo[3,4-e][1,3,2]dioxaphosphépin-6-one [French] [ACD/IUPAC Name]
(3R,8aS)-5-Propyl-3-(tridecyloxy)-8,8a-dihydro-1H,6H-furo[3,4-e][1,3,2]dioxaphosphepin-6-on-3-oxid [German] [ACD/IUPAC Name]
(3R,8aS)-5-Propyl-3-(tridecyloxy)-8,8a-dihydro-1H,6H-furo[3,4-e][1,3,2]dioxaphosphepin-6-one 3-oxide [ACD/IUPAC Name]
1H,6H-Furo[3,4-e][1,3,2]dioxaphosphepin-6-one, 8,8a-dihydro-5-propyl-3-(tridecyloxy)-, 3-oxide, (3R,8aS)- [ACD/Index Name]
Salinipostin H

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

Density: 1.1±0.1 g/cm3
Boiling Point: 515.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 278.4±50.4 °C
Index of Refraction: 1.488
Molar Refractivity: 113.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 6.95
ACD/LogD (pH 5.5): 6.61
ACD/BCF (pH 5.5): 61902.40
ACD/KOC (pH 5.5): 93645.22
ACD/LogD (pH 7.4): 6.61
ACD/BCF (pH 7.4): 61902.40
ACD/KOC (pH 7.4): 93645.22
Polar Surface Area: 81 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 392.7±5.0 cm3

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