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Search term: 24689471 (Found by CSID)
ChemSpider 2D Image | (4S)-4-Hydroxy-3,4-dihydro-2H-spiro[naphthalene-1,2'-naphtho[1,8-de][1,3]dioxine]-5,8-dione | C20H14O5

(4S)-4-Hydroxy-3,4-dihydro-2H-spiro[naphthalene-1,2'-naphtho[1,8-de][1,3]dioxine]-5,8-dione

  • Molecular FormulaC20H14O5
  • Average mass334.322 Da
  • Monoisotopic mass334.084137 Da
  • ChemSpider ID24689471

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-Hydroxy-3,4-dihydro-2H-spiro[naphthalene-1,2'-naphtho[1,8-de][1,3]dioxine]-5,8-dione [ACD/IUPAC Name]
Spiro[naphthalene-1(2H),2'-naphtho[1,8-de][1,3]dioxin]-5,8-dione, 3,4-dihydro-4-hydroxy-, (4S)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL457642/
Palmarumycin CP18

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

Density: 1.5±0.1 g/cm3
Boiling Point: 599.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 223.2±23.6 °C
Index of Refraction: 1.737
Molar Refractivity: 89.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.40
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 341.81
ACD/KOC (pH 5.5): 2266.13
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 341.80
ACD/KOC (pH 7.4): 2266.09
Polar Surface Area: 73 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 73.5±5.0 dyne/cm
Molar Volume: 221.6±5.0 cm3

Click to predict properties on the Chemicalize site


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