CID 45051842

H3ClMgO5 — CID 45051842

IUPAC—
SMILESO.[Mg].[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/ClHO4.Mg.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2
InChIKeyCADOKEGUZVJEKI-UHFFFAOYSA-N
MW142.78 g/mol
LogP-5.33
Rot. Bonds

About CID 45051842

CID 45051842 (PubChem CID 45051842) has the molecular formula H3ClMgO5 and a molecular weight of 142.78 g/mol.

Molecular Properties

Compound NameCID 45051842
PubChem CID45051842
Molecular FormulaH3ClMgO5
Molecular Weight142.78 g/mol
Exact Mass141.95
IUPAC Name—
SMILESO.[Mg].[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/ClHO4.Mg.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2
InChIKeyCADOKEGUZVJEKI-UHFFFAOYSA-N
XLogP-5.33
TPSA120.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.78
LogP ≤ 5-5.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 45051842?
The IUPAC name of CID 45051842 (CID 45051842) is not available.
What is the SMILES notation for CID 45051842?
The canonical SMILES for CID 45051842 is O.[Mg].[O-][Cl+3]([O-])([O-])O.
What is the InChIKey of CID 45051842?
The InChIKey is CADOKEGUZVJEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/ClHO4.Mg.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2.
What are the key properties of CID 45051842?
CID 45051842 has a molecular weight of 142.78 g/mol, XLogP of -5.33, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 45051842 is sourced from PubChem (CID 45051842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).