ChemSpider 2D Image | ?1-tetrahydrocannabiorcol | C17H22O2

?1-tetrahydrocannabiorcol

  • Molecular FormulaC17H22O2
  • Average mass258.355 Da
  • Monoisotopic mass258.161987 Da
  • ChemSpider ID18522304

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6aR,10aR)-3,6,6,9-Tetramethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol [German] [ACD/IUPAC Name]
(6aR,10aR)-3,6,6,9-Tetramethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol [ACD/IUPAC Name]
(6aR,10aR)-3,6,6,9-Tétraméthyl-6a,7,8,10a-tétrahydro-6H-benzo[c]chromén-1-ol [French] [ACD/IUPAC Name]
?1-tetrahydrocannabiorcol
22972-65-2 [RN]
6H-Dibenzo[b,d]pyran-1-ol, 6a,7,8,10a-tetrahydro-3,6,6,9-tetramethyl-, (6aR,10aR)- [ACD/Index Name]
δ9-Tetrahydrocannabiorcol
δ1-Tetrahydrocannabiorcol
δ1-TETRAHYDROCANNABIORCOL
Δ9-Tetrahydrocannabiorcol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5D633LAJ19 [DBID]
UNII:5D633LAJ19 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 326.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.1±3.0 kJ/mol
Flash Point: 123.4±22.1 °C
Index of Refraction: 1.544
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5646.80
ACD/KOC (pH 5.5): 16870.41
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5624.06
ACD/KOC (pH 7.4): 16802.49
Polar Surface Area: 29 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 35.2±3.0 dyne/cm
Molar Volume: 243.7±3.0 cm3

Click to predict properties on the Chemicalize site


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