ChemSpider 2D Image | 4-(Hydroxymethyl)-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxirane]-1,6-diol | C10H12O5

4-(Hydroxymethyl)-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxirane]-1,6-diol

  • Molecular FormulaC10H12O5
  • Average mass212.199 Da
  • Monoisotopic mass212.068466 Da
  • ChemSpider ID35013724

More details:

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

4-(Hydroxymethyl)-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxirane]-1,6-diol [ACD/IUPAC Name]
Spiro[cyclopenta[c]pyran-7(1H),2'-oxirane]-1,6-diol, 6,7a-dihydro-4-(hydroxymethyl)- [ACD/Index Name]
Baldrisedon
Halazuchrome B
valepotriate
Valepotriatum
valtrate [INN]
Valtratum

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

Density: 1.6±0.1 g/cm3
Boiling Point: 566.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.8±6.0 kJ/mol
Flash Point: 296.6±30.1 °C
Index of Refraction: 1.679
Molar Refractivity: 49.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.68
ACD/LogD (pH 5.5): -1.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.07
ACD/LogD (pH 7.4): -1.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.07
Polar Surface Area: 82 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 78.7±5.0 dyne/cm
Molar Volume: 131.5±5.0 cm3

Click to predict properties on the Chemicalize site


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