magnesium;hydride;2-methylpentan-1-ol;hydrochloride

C6H17ClMgO — CID 174286347

IUPACmagnesium;hydride;2-methylpentan-1-ol;hydrochloride
SMILESCCCC(C)CO.Cl.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H14O.ClH.Mg.2H/c1-3-4-6(2)5-7;;;;/h6-7H,3-5H2,1-2H3;1H;;;/q;;+2;2*-1
InChIKeyCTAGHVNTGDZKHA-UHFFFAOYSA-N
MW164.96 g/mol
LogP1.68
Rot. Bonds3

About magnesium;hydride;2-methylpentan-1-ol;hydrochloride

magnesium;hydride;2-methylpentan-1-ol;hydrochloride (PubChem CID 174286347) has the molecular formula C6H17ClMgO and a molecular weight of 164.96 g/mol. Its IUPAC name is magnesium;hydride;2-methylpentan-1-ol;hydrochloride.

Molecular Properties

Compound Namemagnesium;hydride;2-methylpentan-1-ol;hydrochloride
PubChem CID174286347
Molecular FormulaC6H17ClMgO
Molecular Weight164.96 g/mol
Exact Mass164.08
IUPAC Namemagnesium;hydride;2-methylpentan-1-ol;hydrochloride
SMILESCCCC(C)CO.Cl.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H14O.ClH.Mg.2H/c1-3-4-6(2)5-7;;;;/h6-7H,3-5H2,1-2H3;1H;;;/q;;+2;2*-1
InChIKeyCTAGHVNTGDZKHA-UHFFFAOYSA-N
XLogP1.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.96
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

azane;2-methylpentan-1-ol;dihydrochloride
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2-methylpentan-1-ol;4-methylpentan-2-ol
CID 160710819
2-methylhexan-1-ol
CID 159157237
2-methylpentanal;(2S)-2-methylpentanal;(2R)-2-methylpentan-1-ol;sulfane
CID 169429649
3-methyl-4-(2-methylpentylamino)butan-1-ol
CID 66092685
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
carbanide;2-methylbutane-1,4-diol;titanium(2+)
CID 134981469
2-methylhexadecan-1-ol
CID 17218
(2R)-2-methyloctadecan-1-ol
CID 122453872
2,6-dimethylheptane-1,7-diol
CID 12653721
(2R,6R)-2,6-dimethylheptane-1,7-diol
CID 10534981

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;2-methylpentan-1-ol;hydrochloride?
The IUPAC name of magnesium;hydride;2-methylpentan-1-ol;hydrochloride (CID 174286347) is magnesium;hydride;2-methylpentan-1-ol;hydrochloride.
What is the SMILES notation for magnesium;hydride;2-methylpentan-1-ol;hydrochloride?
The canonical SMILES for magnesium;hydride;2-methylpentan-1-ol;hydrochloride is CCCC(C)CO.Cl.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;2-methylpentan-1-ol;hydrochloride?
The InChIKey is CTAGHVNTGDZKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O.ClH.Mg.2H/c1-3-4-6(2)5-7;;;;/h6-7H,3-5H2,1-2H3;1H;;;/q;;+2;2*-1.
What are the key properties of magnesium;hydride;2-methylpentan-1-ol;hydrochloride?
magnesium;hydride;2-methylpentan-1-ol;hydrochloride has a molecular weight of 164.96 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;2-methylpentan-1-ol;hydrochloride is sourced from PubChem (CID 174286347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).