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Cobalt(II) oxalate structure
Cobalt(II) oxalate structure

Cobalt(II) oxalate

Iupac Name:cobalt(2+);oxalate
CAS No.: 134761-87-8
Molecular Weight:146.951
Modify Date.: 2022-10-29 03:04
1. Names and Identifiers
1.1 Name
Cobalt(II) oxalate
1.2 Synonyms

ACMC-1BZOK AKOS025295782 C2CoO4 Cobalt oxalate Cobalt oxalate (1:1) Cobalt oxalate (CoC2O4) Cobalt oxalate (VAN) cobalt(2+):oxalate Cobalt(II) oxalate anhydrous CTK0G9972 DTXSID10883588 EC 212-409-3 EINECS 212-409-3 Ethanedioic acid, cobalt(2+) salt (1:1) FT-0694915 K452 MFCD00050793 NSC 112245 Oxalic acid cobalt(2+) salt (1:1) Oxalic acid cobalt(II) Oxalic acid, cobalt(2+) salt (1:1) (8CI) Q5138694 R028MNY8UA UNII-R028MNY8UA

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1.3 CAS No.
134761-87-8
1.4 CID
69946
1.5 Molecular Formula
C2CoO4 (isomer)
1.6 Inchi
InChI=1S/C2H2O4.Co/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
1.7 InChIkey
MULYSYXKGICWJF-UHFFFAOYSA-L
1.8 Canonical Smiles
C(=O)(C(=O)[O-])[O-].[Co+2]
1.9 Isomers Smiles
C(=O)(C(=O)[O-])[O-].[Co+2]
2. Properties
2.1 PSA
80.26000
3. Computational chemical data
  • Molecular Weight: 146.951g/mol
  • Molecular Formula: C2CoO4
  • Compound Is Canonicalized: True
  • XLogP3-AA: null
  • Exact Mass: 146.912852
  • Monoisotopic Mass: 146.912852
  • Complexity: 60.5
  • Rotatable Bond Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Topological Polar Surface Area: 80.3
  • Heavy Atom Count: 7
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 2
  • CACTVS Substructure Key Fingerprint: AAADcQBAOAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACgAAAAAAAAAAgAAACAAAAAAIAACQCAIAAAAAAAAAAABAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
5. Realated Product Infomation