ChemSpider 2D Image | (1S,2S,4aR,5R,8R,8aR)-8-[(5R)-5-Chloro-2,6,6-trimethyltetrahydro-2H-pyran-2-yl]-1,5-diisocyano-2,5-dimethyldecahydro-2-naphthalenol | C22H33ClN2O2

(1S,2S,4aR,5R,8R,8aR)-8-[(5R)-5-Chloro-2,6,6-trimethyltetrahydro-2H-pyran-2-yl]-1,5-diisocyano-2,5-dimethyldecahydro-2-naphthalenol

  • Molecular FormulaC22H33ClN2O2
  • Average mass392.963 Da
  • Monoisotopic mass392.223053 Da
  • ChemSpider ID30790948
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(1S,2S,4aR,5R,8R,8aR)-8-[(5R)-5-Chlor-2,6,6-trimethyltetrahydro-2H-pyran-2-yl]-1,5-diisocyano-2,5-dimethyldecahydro-2-naphthalinol [German] [ACD/IUPAC Name]
(1S,2S,4aR,5R,8R,8aR)-8-[(5R)-5-Chloro-2,6,6-triméthyltétrahydro-2H-pyran-2-yl]-1,5-diisocyano-2,5-diméthyldécahydro-2-naphtalénol [French] [ACD/IUPAC Name]
(1S,2S,4aR,5R,8R,8aR)-8-[(5R)-5-Chloro-2,6,6-trimethyltetrahydro-2H-pyran-2-yl]-1,5-diisocyano-2,5-dimethyldecahydro-2-naphthalenol [ACD/IUPAC Name]
2-Naphthalenol, 8-[(5R)-5-chlorotetrahydro-2,6,6-trimethyl-2H-pyran-2-yl]decahydro-1,5-diisocyano-2,5-dimethyl-, (1S,2S,4aR,5R,8R,8aR)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 38 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






Advertisement