Found 1 result

Search term: 30777167 (Found by CSID)
ChemSpider 2D Image | (1R,2R,7aR)-1,4,4,7a-Tetramethyl-2,4,5,7a-tetrahydro-1H-indene-1,2-diol | C13H20O2

(1R,2R,7aR)-1,4,4,7a-Tetramethyl-2,4,5,7a-tetrahydro-1H-indene-1,2-diol

  • Molecular FormulaC13H20O2
  • Average mass208.297 Da
  • Monoisotopic mass208.146332 Da
  • ChemSpider ID30777167

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,2R,7aR)-1,4,4,7a-Tetramethyl-2,4,5,7a-tetrahydro-1H-inden-1,2-diol [German] [ACD/IUPAC Name]
(1R,2R,7aR)-1,4,4,7a-Tetramethyl-2,4,5,7a-tetrahydro-1H-indene-1,2-diol [ACD/IUPAC Name]
(1R,2R,7aR)-1,4,4,7a-Tétraméthyl-2,4,5,7a-tétrahydro-1H-indène-1,2-diol [French] [ACD/IUPAC Name]
1H-Indene-1,2-diol, 2,4,5,7a-tetrahydro-1,4,4,7a-tetramethyl-, (1R,2R,7aR)- [ACD/Index Name]
99901-24-3 [RN]
(1R,2R,7aR)-1,4,4,7a-tetramethyl-2,5-dihydroindene-1,2-diol
2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-diene-7,8-diol
2,4,5,7a-Tetrahydro-1,4,4,7a-tetramethyl-1H-indene-1,2-diol, 9CI

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 302.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 63.0±6.0 kJ/mol
Flash Point: 137.1±19.2 °C
Index of Refraction: 1.556
Molar Refractivity: 60.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.54
ACD/KOC (pH 5.5): 585.01
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.54
ACD/KOC (pH 7.4): 585.01
Polar Surface Area: 40 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 42.9±5.0 dyne/cm
Molar Volume: 189.1±5.0 cm3

Click to predict properties on the Chemicalize site


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