Found 1 result

Search term: 26389822 (Found by CSID)
ChemSpider 2D Image | (1S,2R,3R,4E,6S,7R,14R,16R)-2,6-Dihydroxy-1,7,16-trimethyl-13,17-dioxatetracyclo[9.5.2.0~3,14~.0~14,18~]octadeca-4,11(18)-diene-10,12-dione | C19H24O6

(1S,2R,3R,4E,6S,7R,14R,16R)-2,6-Dihydroxy-1,7,16-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadeca-4,11(18)-diene-10,12-dione

  • Molecular FormulaC19H24O6
  • Average mass348.390 Da
  • Monoisotopic mass348.157288 Da
  • ChemSpider ID26389822

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(1S,2R,3R,4E,6S,7R,14R,16R)-2,6-Dihydroxy-1,7,16-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadeca-4,11(18)-dien-10,12-dion [German] [ACD/IUPAC Name]
(1S,2R,3R,4E,6S,7R,14R,16R)-2,6-Dihydroxy-1,7,16-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadeca-4,11(18)-diene-10,12-dione [ACD/IUPAC Name]
(1S,2R,3R,4E,6S,7R,14R,16R)-2,6-Dihydroxy-1,7,16-triméthyl-13,17-dioxatétracyclo[9.5.2.03,14.014,18]octadéca-4,11(18)-diène-10,12-dione [French] [ACD/IUPAC Name]
12,14a,3-(Epoxymethanediylylidene)-2H-1-benzoxacyclododecin-2,4(5H)-dione, 6,7,8,10a,11,12,13,14-octahydro-8,11-dihydroxy-7,12,13-trimethyl-, (7R,8S,9E,10aR,11R,12S,13R,14aR)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 583.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.1±6.0 kJ/mol
Flash Point: 211.1±23.6 °C
Index of Refraction: 1.599
Molar Refractivity: 87.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.06
ACD/KOC (pH 5.5): 36.24
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.06
ACD/KOC (pH 7.4): 36.24
Polar Surface Area: 93 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 57.5±5.0 dyne/cm
Molar Volume: 257.2±5.0 cm3

Click to predict properties on the Chemicalize site


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