magnesium;hydride;oxolane;titanium;pentahydrochloride

C4H15Cl5MgOTi — CID 174554825

IUPACmagnesium;hydride;oxolane;titanium;pentahydrochloride
SMILESC1CCOC1.Cl.Cl.Cl.Cl.Cl.[H-].[H-].[Mg+2].[Ti]
InChIInChI=1S/C4H8O.5ClH.Mg.Ti.2H/c1-2-4-5-3-1;;;;;;;;;/h1-4H2;5*1H;;;;/q;;;;;;+2;;2*-1
InChIKeyYNKCOKRGYJSYTH-UHFFFAOYSA-N
MW328.60 g/mol
LogP2.75
Rot. Bonds

About magnesium;hydride;oxolane;titanium;pentahydrochloride

magnesium;hydride;oxolane;titanium;pentahydrochloride (PubChem CID 174554825) has the molecular formula C4H15Cl5MgOTi and a molecular weight of 328.60 g/mol. Its IUPAC name is magnesium;hydride;oxolane;titanium;pentahydrochloride.

Molecular Properties

Compound Namemagnesium;hydride;oxolane;titanium;pentahydrochloride
PubChem CID174554825
Molecular FormulaC4H15Cl5MgOTi
Molecular Weight328.60 g/mol
Exact Mass325.89
IUPAC Namemagnesium;hydride;oxolane;titanium;pentahydrochloride
SMILESC1CCOC1.Cl.Cl.Cl.Cl.Cl.[H-].[H-].[Mg+2].[Ti]
InChIInChI=1S/C4H8O.5ClH.Mg.Ti.2H/c1-2-4-5-3-1;;;;;;;;;/h1-4H2;5*1H;;;;/q;;;;;;+2;;2*-1
InChIKeyYNKCOKRGYJSYTH-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.60
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;oxolane;titanium;pentahydrochloride?
The IUPAC name of magnesium;hydride;oxolane;titanium;pentahydrochloride (CID 174554825) is magnesium;hydride;oxolane;titanium;pentahydrochloride.
What is the SMILES notation for magnesium;hydride;oxolane;titanium;pentahydrochloride?
The canonical SMILES for magnesium;hydride;oxolane;titanium;pentahydrochloride is C1CCOC1.Cl.Cl.Cl.Cl.Cl.[H-].[H-].[Mg+2].[Ti].
What is the InChIKey of magnesium;hydride;oxolane;titanium;pentahydrochloride?
The InChIKey is YNKCOKRGYJSYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.5ClH.Mg.Ti.2H/c1-2-4-5-3-1;;;;;;;;;/h1-4H2;5*1H;;;;/q;;;;;;+2;;2*-1.
What are the key properties of magnesium;hydride;oxolane;titanium;pentahydrochloride?
magnesium;hydride;oxolane;titanium;pentahydrochloride has a molecular weight of 328.60 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;oxolane;titanium;pentahydrochloride is sourced from PubChem (CID 174554825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).