CID 158189288

C10H20CaNa3O10 — CID 158189288

IUPAC—
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Ca].[Na].[Na].[Na]
InChIInChI=1S/5C2H4O2.Ca.3Na/c5*1-2(3)4;;;;/h5*1H3,(H,3,4);;;;
InChIKeyFZNUDCPCPVZAJJ-UHFFFAOYSA-N
MW409.31 g/mol
LogP-1.07
Rot. Bonds

About CID 158189288

CID 158189288 (PubChem CID 158189288) has the molecular formula C10H20CaNa3O10 and a molecular weight of 409.31 g/mol.

Molecular Properties

Compound NameCID 158189288
PubChem CID158189288
Molecular FormulaC10H20CaNa3O10
Molecular Weight409.31 g/mol
Exact Mass409.04
IUPAC Name—
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Ca].[Na].[Na].[Na]
InChIInChI=1S/5C2H4O2.Ca.3Na/c5*1-2(3)4;;;;/h5*1H3,(H,3,4);;;;
InChIKeyFZNUDCPCPVZAJJ-UHFFFAOYSA-N
XLogP-1.07
TPSA186.50 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.31
LogP ≤ 5-1.07
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 158189288?
The IUPAC name of CID 158189288 (CID 158189288) is not available.
What is the SMILES notation for CID 158189288?
The canonical SMILES for CID 158189288 is CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Ca].[Na].[Na].[Na].
What is the InChIKey of CID 158189288?
The InChIKey is FZNUDCPCPVZAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/5C2H4O2.Ca.3Na/c5*1-2(3)4;;;;/h5*1H3,(H,3,4);;;;.
What are the key properties of CID 158189288?
CID 158189288 has a molecular weight of 409.31 g/mol, XLogP of -1.07, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158189288 is sourced from PubChem (CID 158189288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).