ChemSpider 2D Image | RCL T298247 | C27H30O2

RCL T298247

  • Molecular FormulaC27H30O2
  • Average mass386.526 Da
  • Monoisotopic mass386.224579 Da
  • ChemSpider ID22900746

  • defined stereocentres - 1 of 14 defined stereocentres

More details:

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

[(7R)-7-(Phenoxymethyl)-1,1a,1b,2,3,3a,3b,3c,4,6,6a,6b,6c,6d,6e,6f-hexadecahydro-1,6-methanocyclopenta[cd]pentaleno[2',1',6':3,4,5]pentaleno[2,1,6-gha]pentalen-7-yl]methanol [ACD/IUPAC Name]
[(7R)-7-(Phenoxymethyl)-1,1a,1b,2,3,3a,3b,3c,4,6,6a,6b,6c,6d,6e,6f-hexadecahydro-1,6-methanocyclopenta[cd]pentaleno[2',1',6':3,4,5]pentaleno[2,1,6-gha]pentalen-7-yl]methanol [German] [ACD/IUPAC Name]
[(7R)-7-(Phénoxyméthyl)-1,1a,1b,2,3,3a,3b,3c,4,6,6a,6b,6c,6d,6e,6f-hexadécahydro-1,6-méthanocyclopenta[cd]pentaléno[2',1',6':3,4,5]pentaléno[2,1,6-gha]pentalén-7-yl]méthanol [French] [ACD/IUPAC Name]
1,6-Methanocyclopenta[cd]pentaleno[2',1',6':3,4,5]pentaleno[2,1,6-gha]pentalene-7-methanol, 1,1a,1b,2,3,3a,3b,3c,4,6,6a,6b,6c,6d,6e,6f-hexadecahydro-7-(phenoxymethyl)-, (7R)- [ACD/Index Name]
MFCD11502550
RCL T298247

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.694
Molar Refractivity: 110.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 5.56
ACD/BCF (pH 5.5): 9870.43
ACD/KOC (pH 5.5): 25161.43
ACD/LogD (pH 7.4): 5.56
ACD/BCF (pH 7.4): 9870.43
ACD/KOC (pH 7.4): 25161.43
Polar Surface Area: 29 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 60.2±5.0 dyne/cm
Molar Volume: 287.3±5.0 cm3

Click to predict properties on the Chemicalize site


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