2-anthracenecar- boxylate sodium salt | SBID = 2051 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C15H9NaO2
M / g/mol: 244.22053
Complexity:
Number of Conformers:

Identifiers

  • Tags:
  • Name: 2-anthracenecar- boxylate sodium salt
  • Preferred Abbreviation: 2-anthracenecar- boxylate sodium salt
  • IUPAC Name:
  • CAS:
  • CID: -882
  • InChiKey: KEPTWXGUWBXXTF-UHFFFAOYSA-M
  • InChi: InChI=1S/C15H10O2.Na/c16-15(17)13-6-5-12-7-10-3-1-2-4-11(10)8-14(12)9-13;/h1-9H,(H,16,17);/q;+1/p-1
  • CanoSmiles: [Na]OC(=O)c1ccc2c(c1)cc1c(c2)cccc1
  • IsoSmiles: O=C(C1=CC2=CC3=CC=CC=C3C=C2C=C1)O[Na]