ChemSpider 2D Image | (3alpha,4beta)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl di(~13~C_2_)acetate | C1513C4H26O7

(3α,4β)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl di(13C2)acetate

  • Molecular FormulaC1513C4H26O7
  • Average mass370.376 Da
  • Monoisotopic mass370.181274 Da
  • ChemSpider ID107450599

  • defined stereocentres - 7 of 7 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3α,4β)-3-Hydroxy-12,13-epoxytrichothec-9-en-4,15-diyl-di(13C2)acetat [German] [ACD/IUPAC Name]
(3α,4β)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl di(13C2)acetate [ACD/IUPAC Name]
Acetic-13C2 acid, (3α,4β)-12,13-epoxy-3-hydroxytrichothec-9-ene-4,15-diyl ester [ACD/Index Name]
Di(13C2)acétate de (3α,4β)-3-hydroxy-12,13-époxytrichothec-9-ène-4,15-diyle [French] [ACD/IUPAC Name]
910537-26-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.561
Molar Refractivity: 90.2±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 278.6±5.0 cm3

Click to predict properties on the Chemicalize site


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