ChemSpider 2D Image | (29S)-1,29-Triacontanediol | C30H62O2

(29S)-1,29-Triacontanediol

  • Molecular FormulaC30H62O2
  • Average mass454.812 Da
  • Monoisotopic mass454.474976 Da
  • ChemSpider ID34990626

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(29S)-1,29-Triacontandiol [German] [ACD/IUPAC Name]
(29S)-1,29-Triacontanediol [ACD/IUPAC Name]
(29S)-1,29-Triacontanediol [French] [ACD/IUPAC Name]
1,29-Triacontanediol, (29S)- [ACD/Index Name]
1,29-Triacontanediol [ACD/Index Name] [ACD/IUPAC Name]
85774-69-2 [RN]
UNII-FYS4J8553D

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

Density: 0.9±0.1 g/cm3
Boiling Point: 552.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 95.8±6.0 kJ/mol
Flash Point: 212.8±17.2 °C
Index of Refraction: 1.467
Molar Refractivity: 144.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 28
#Rule of 5 Violations: 1
ACD/LogP: 12.50
ACD/LogD (pH 5.5): 10.84
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.84
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 40 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 519.1±3.0 cm3

Click to predict properties on the Chemicalize site


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