CID 175064791

H2Al2Cl5O — CID 175064791

IUPAC—
SMILESO.[Al+3].[Al+]Cl.[Cl-].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/2Al.5ClH.H2O/h;;5*1H;1H2/q+2;+3;;;;;;/p-5
InChIKeyXHPXOFANOGNOCR-UHFFFAOYSA-I
MW249.24 g/mol
LogP-12.88
Rot. Bonds

About CID 175064791

CID 175064791 (PubChem CID 175064791) has the molecular formula H2Al2Cl5O and a molecular weight of 249.24 g/mol.

Molecular Properties

Compound NameCID 175064791
PubChem CID175064791
Molecular FormulaH2Al2Cl5O
Molecular Weight249.24 g/mol
Exact Mass246.82
IUPAC Name—
SMILESO.[Al+3].[Al+]Cl.[Cl-].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/2Al.5ClH.H2O/h;;5*1H;1H2/q+2;+3;;;;;;/p-5
InChIKeyXHPXOFANOGNOCR-UHFFFAOYSA-I
XLogP-12.88
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 5-12.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 175064791?
The IUPAC name of CID 175064791 (CID 175064791) is not available.
What is the SMILES notation for CID 175064791?
The canonical SMILES for CID 175064791 is O.[Al+3].[Al+]Cl.[Cl-].[Cl-].[Cl-].[Cl-].
What is the InChIKey of CID 175064791?
The InChIKey is XHPXOFANOGNOCR-UHFFFAOYSA-I. The full InChI is InChI=1S/2Al.5ClH.H2O/h;;5*1H;1H2/q+2;+3;;;;;;/p-5.
What are the key properties of CID 175064791?
CID 175064791 has a molecular weight of 249.24 g/mol, XLogP of -12.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175064791 is sourced from PubChem (CID 175064791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).