CID 170847227

C6H8CoKO7 — CID 170847227

IUPAC—
SMILESO=C(O)CC(O)(CC(=O)O)C(=O)O.[Co].[K]
InChIInChI=1S/C6H8O7.Co.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;
InChIKeyNETYWGFIQMMTSG-UHFFFAOYSA-N
MW290.15 g/mol
LogP-1.63
Rot. Bonds5

About CID 170847227

CID 170847227 (PubChem CID 170847227) has the molecular formula C6H8CoKO7 and a molecular weight of 290.15 g/mol.

Molecular Properties

Compound NameCID 170847227
PubChem CID170847227
Molecular FormulaC6H8CoKO7
Molecular Weight290.15 g/mol
Exact Mass289.92
IUPAC Name—
SMILESO=C(O)CC(O)(CC(=O)O)C(=O)O.[Co].[K]
InChIInChI=1S/C6H8O7.Co.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;
InChIKeyNETYWGFIQMMTSG-UHFFFAOYSA-N
XLogP-1.63
TPSA132.13 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.15
LogP ≤ 5-1.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 170847227?
The IUPAC name of CID 170847227 (CID 170847227) is not available.
What is the SMILES notation for CID 170847227?
The canonical SMILES for CID 170847227 is O=C(O)CC(O)(CC(=O)O)C(=O)O.[Co].[K].
What is the InChIKey of CID 170847227?
The InChIKey is NETYWGFIQMMTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O7.Co.K/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;.
What are the key properties of CID 170847227?
CID 170847227 has a molecular weight of 290.15 g/mol, XLogP of -1.63, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170847227 is sourced from PubChem (CID 170847227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).