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Inherent Properties, Identifiers and References
ChemSpider ID: 4954499
Empirical Formula: C14H8Na2O2
Molecular Weight: 254.1917
Nominal Mass: 254 Da
Average Mass: 254.1917 Da
Monoisotopic Mass: 254.031969 Da
Quick Links: Permalink Similar Isomers
Systematic Name: disodium anthracene-9,10-diolate
SMILES: [Na+].[Na+].[O-]c2c1c(cccc1)c([O-])c3c2cccc3
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/p-2
InChIKey: RMEKRPRYWRUTKH-NUQVWONBAE
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Names and Synonyms

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

46492-07-3 [RN]

87134-92-7 [RN]

9,10-Anth​racenedio​l, disodi​um salt

(Details...) Predicted Properties
LogP: ACD/LogP: 3.19
# of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 3.19 ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 5.5): 155.78 ACD/BCF (pH 7.4): 155.72
ACD/KOC (pH 5.5): 1291.22 ACD/KOC (pH 7.4): 1290.76
#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: 240.4 °C Enthalpy of Vaporization: 76.66 kJ/mol
Boiling Point: 475 °C at 760 mmHg Vapour Pressure: 1.21E-09 mmHg at 25°C