cobalt;formic acid;dihydrate

C2H8CoO6 — CID 91886430

IUPACcobalt;formic acid;dihydrate
SMILESO.O.O=CO.O=CO.[Co]
InChIInChI=1S/2CH2O2.Co.2H2O/c2*2-1-3;;;/h2*1H,(H,2,3);;2*1H2
InChIKeyGURJXSQVJCOKSI-UHFFFAOYSA-N
MW187.01 g/mol
LogP-2.25
Rot. Bonds

About cobalt;formic acid;dihydrate

cobalt;formic acid;dihydrate (PubChem CID 91886430) has the molecular formula C2H8CoO6 and a molecular weight of 187.01 g/mol. Its IUPAC name is cobalt;formic acid;dihydrate.

Molecular Properties

Compound Namecobalt;formic acid;dihydrate
PubChem CID91886430
Molecular FormulaC2H8CoO6
Molecular Weight187.01 g/mol
Exact Mass186.97
IUPAC Namecobalt;formic acid;dihydrate
SMILESO.O.O=CO.O=CO.[Co]
InChIInChI=1S/2CH2O2.Co.2H2O/c2*2-1-3;;;/h2*1H,(H,2,3);;2*1H2
InChIKeyGURJXSQVJCOKSI-UHFFFAOYSA-N
XLogP-2.25
TPSA137.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.01
LogP ≤ 5-2.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cobalt;formic acid;dihydrate?
The IUPAC name of cobalt;formic acid;dihydrate (CID 91886430) is cobalt;formic acid;dihydrate.
What is the SMILES notation for cobalt;formic acid;dihydrate?
The canonical SMILES for cobalt;formic acid;dihydrate is O.O.O=CO.O=CO.[Co].
What is the InChIKey of cobalt;formic acid;dihydrate?
The InChIKey is GURJXSQVJCOKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/2CH2O2.Co.2H2O/c2*2-1-3;;;/h2*1H,(H,2,3);;2*1H2.
What are the key properties of cobalt;formic acid;dihydrate?
cobalt;formic acid;dihydrate has a molecular weight of 187.01 g/mol, XLogP of -2.25, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;formic acid;dihydrate is sourced from PubChem (CID 91886430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).