ChemSpider 2D Image | (3R,3aS,3bR,4R,7R,7aR)-4-(2-Isocyano-2-propanyl)-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzene | C16H25N

(3R,3aS,3bR,4R,7R,7aR)-4-(2-Isocyano-2-propanyl)-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzene

  • Molecular FormulaC16H25N
  • Average mass231.376 Da
  • Monoisotopic mass231.198700 Da
  • ChemSpider ID35517090

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3R,3aS,3bR,4R,7R,7aR)-4-(2-Isocyano-2-propanyl)-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzene [ACD/IUPAC Name]
(3R,3aS,3bR,4R,7R,7aR)-4-(2-Isocyano-2-propanyl)-3,7-diméthyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzène [French] [ACD/IUPAC Name]
(3R,3aS,3bR,4R,7R,7aR)-4-(2-Isocyano-2-propanyl)-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzol [German] [ACD/IUPAC Name]
1H-Cyclopenta[1,3]cyclopropa[1,2]benzene, octahydro-4-(1-isocyano-1-methylethyl)-3,7-dimethyl-, (3R,3aS,3bR,4R,7R,7aR)- [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#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: 4 Å2
Polarizability:
Surface Tension:
Molar Volume:

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