ChemSpider 2D Image | (5xi)-12-[(5xi)-13-Hydroxy-14-isopropylpodocarpa-8,11,13-trien-12-yl]-14-isopropylpodocarpa-8,11,13-trien-13-ol | C40H58O2

(5ξ)-12-[(5ξ)-13-Hydroxy-14-isopropylpodocarpa-8,11,13-trien-12-yl]-14-isopropylpodocarpa-8,11,13-trien-13-ol

  • Molecular FormulaC40H58O2
  • Average mass570.887 Da
  • Monoisotopic mass570.443665 Da
  • ChemSpider ID4478679

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

(5ξ)-12-[(5ξ)-13-Hydroxy-14-isopropylpodocarpa-8,11,13-trien-12-yl]-14-isopropylpodocarpa-8,11,13-trien-13-ol [ACD/IUPAC Name]
(5ξ)-12-[(5ξ)-13-Hydroxy-14-isopropylpodocarpa-8,11,13-trien-12-yl]-14-isopropylpodocarpa-8,11,13-trien-13-ol [German] [ACD/IUPAC Name]
(5ξ)-12-[(5ξ)-13-Hydroxy-14-isopropylpodocarpa-8,11,13-trién-12-yl]-14-isopropylpodocarpa-8,11,13-trién-13-ol [French] [ACD/IUPAC Name]
[3,3'-Biphenanthrene]-2,2'-diol, 4b,4'b,5,5',6,6',7,7',8,8',8a,8'a,9,9',10,10'-hexadecahydro-4b,4'b,8,8,8',8'-hexamethyl-1,1'-bis(1-methylethyl)-, (4bS,4b'S)- [ACD/Index Name]
PODOTOTARIN

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

DivK1c_006224 [DBID]
KBio1_001168 [DBID]
KBio2_001566 [DBID]
KBio2_004134 [DBID]
KBio2_006702 [DBID]
KBio3_002235 [DBID]
KBioGR_001620 [DBID]
KBioSS_001566 [DBID]
SDCCGMLS-0066305.P001 [DBID]
SpecPlus_000128 [DBID]
More...

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

Density: 1.0±0.1 g/cm3
Boiling Point: 611.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 230.3±26.1 °C
Index of Refraction: 1.551
Molar Refractivity: 177.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 14.07
ACD/LogD (pH 5.5): 12.78
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.78
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 40 Å2
Polarizability: 70.3±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 555.7±3.0 cm3

Click to predict properties on the Chemicalize site


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