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Creative Commons Attribution-ShareAlike 3.0 United States Inherent Properties, Identifiers and References
ChemSpider ID: 16352795
Empirical Formula: C14H10Na2O2
Molecular Weight: 256.2064
Nominal Mass: 256 Da
Average Mass: 256.2064 Da
Monoisotopic Mass: 256.046522 Da
Systematic Name: disodium anthracene-9,10-diol
SMILES: [Na+].[Na+].Oc2c1ccccc1c(O)c3ccccc23
InChI: InChI=1/C14H10O2.2Na/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12​)13;;/h1-8,15-16H;;/q;2*+1
InChIKey: RMEKRPRYWRUTKH-UHFFFAOYAU
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(Details...) Names and Synonyms Creative Commons Attribution-ShareAlike 3.0 United States

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9,10-Anthracenediol, disodium salt
(Details...) Predicted Properties
LogP: # of Rule of 5 Violations:
ACD/LogD (pH 5.5): ACD/LogD (pH 7.4):
ACD/BCF (pH 5.5): ACD/BCF (pH 7.4):
ACD/KOC (pH 5.5): ACD/KOC (pH 7.4):
#H bond acceptors: 2 #H bond donors: 2
#Freely Rotating Bonds: 2 Polar Surface Area: 40.46 Å2
Index of Refraction: Molar Refractivity: cm3
Molar Volume: cm3 Polarizability: 10-24cm3
Surface Tension: dyne/cm Density: g/cm3
Flash Point: °C Enthalpy of Vaporization: kJ/mol
Boiling Point: °C at 760 mmHg Vapour Pressure: mmHg at 25°C
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DateSeverityStatusFeedback
4/29/2008 3:42:04 PMNormalNewdisodium salt or anthracene-9,10-diol ???