dicalcium;potassium;hydride;trichloride;hydrate

H4Ca2Cl3KO — CID 174989026

IUPACdicalcium;potassium;hydride;trichloride;hydrate
SMILESO.[Ca+2].[Ca+2].[Cl-].[Cl-].[Cl-].[H-].[H-].[K+]
InChIInChI=1S/2Ca.3ClH.K.H2O.2H/h;;3*1H;;1H2;;/q2*+2;;;;+1;;2*-1/p-3
InChIKeyHJHKUWAWCKKREM-UHFFFAOYSA-K
MW245.64 g/mol
LogP-13.35
Rot. Bonds

About dicalcium;potassium;hydride;trichloride;hydrate

dicalcium;potassium;hydride;trichloride;hydrate (PubChem CID 174989026) has the molecular formula H4Ca2Cl3KO and a molecular weight of 245.64 g/mol. Its IUPAC name is dicalcium;potassium;hydride;trichloride;hydrate.

Molecular Properties

Compound Namedicalcium;potassium;hydride;trichloride;hydrate
PubChem CID174989026
Molecular FormulaH4Ca2Cl3KO
Molecular Weight245.64 g/mol
Exact Mass243.82
IUPAC Namedicalcium;potassium;hydride;trichloride;hydrate
SMILESO.[Ca+2].[Ca+2].[Cl-].[Cl-].[Cl-].[H-].[H-].[K+]
InChIInChI=1S/2Ca.3ClH.K.H2O.2H/h;;3*1H;;1H2;;/q2*+2;;;;+1;;2*-1/p-3
InChIKeyHJHKUWAWCKKREM-UHFFFAOYSA-K
XLogP-13.35
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.64
LogP ≤ 5-13.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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potassium;hydride;stibane;hydrate
CID 173450334
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Frequently Asked Questions

What is the IUPAC name of dicalcium;potassium;hydride;trichloride;hydrate?
The IUPAC name of dicalcium;potassium;hydride;trichloride;hydrate (CID 174989026) is dicalcium;potassium;hydride;trichloride;hydrate.
What is the SMILES notation for dicalcium;potassium;hydride;trichloride;hydrate?
The canonical SMILES for dicalcium;potassium;hydride;trichloride;hydrate is O.[Ca+2].[Ca+2].[Cl-].[Cl-].[Cl-].[H-].[H-].[K+].
What is the InChIKey of dicalcium;potassium;hydride;trichloride;hydrate?
The InChIKey is HJHKUWAWCKKREM-UHFFFAOYSA-K. The full InChI is InChI=1S/2Ca.3ClH.K.H2O.2H/h;;3*1H;;1H2;;/q2*+2;;;;+1;;2*-1/p-3.
What are the key properties of dicalcium;potassium;hydride;trichloride;hydrate?
dicalcium;potassium;hydride;trichloride;hydrate has a molecular weight of 245.64 g/mol, XLogP of -13.35, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicalcium;potassium;hydride;trichloride;hydrate is sourced from PubChem (CID 174989026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).