Found 17 results

Search term: CECREIRZLPLYDM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (-)-Manool | C20H34O

(-)-Manool

  • Molecular FormulaC20H34O
  • Average mass290.483 Da
  • Monoisotopic mass290.260956 Da
  • ChemSpider ID30786117

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(-)-Manool
(13S)-ent-manool
(3S)-3-Methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylendecahydro-1-naphthalinyl]-1-penten-3-ol [German] [ACD/IUPAC Name]
(3S)-3-Méthyl-5-[(1R,4aR,8aR)-5,5,8a-triméthyl-2-méthylènedécahydro-1-naphtalényl]-1-pentén-3-ol [French] [ACD/IUPAC Name]
(3S)-3-Methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]-1-penten-3-ol [ACD/IUPAC Name]
1-Naphthalenepropanol, α-ethenyldecahydro-α,5,5,8a-tetramethyl-2-methylene-, (αS,1R,4aR,8aR)- [ACD/Index Name]
ent-manool
(3S)-3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl]pent-1-en-3-ol
ent-manool
ent-labda-8(17),14-dien-13R-ol

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

Density: 0.9±0.1 g/cm3
Boiling Point: 368.2±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.1±6.0 kJ/mol
Flash Point: 118.2±15.6 °C
Index of Refraction: 1.501
Molar Refractivity: 91.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.19
ACD/LogD (pH 5.5): 6.57
ACD/BCF (pH 5.5): 58105.64
ACD/KOC (pH 5.5): 89497.09
ACD/LogD (pH 7.4): 6.57
ACD/BCF (pH 7.4): 58105.64
ACD/KOC (pH 7.4): 89497.09
Polar Surface Area: 20 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 33.9±5.0 dyne/cm
Molar Volume: 310.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement