1-Hexanol, 2-ethyl-, magnesium salt (2:1)

C8H18MgO — CID 74764164

IUPAC—
SMILESCCCCC(CC)CO.[Mg]
InChIInChI=1S/C8H18O.Mg/c1-3-5-6-8(4-2)7-9;/h8-9H,3-7H2,1-2H3;
InChIKeyWVWIZJDEQLMIQA-UHFFFAOYSA-N
MW154.54 g/mol
LogP1.81
Rot. Bonds5

About 1-Hexanol, 2-ethyl-, magnesium salt (2:1)

1-Hexanol, 2-ethyl-, magnesium salt (2:1) (PubChem CID 74764164) has the molecular formula C8H18MgO and a molecular weight of 154.54 g/mol.

Molecular Properties

Compound Name1-Hexanol, 2-ethyl-, magnesium salt (2:1)
PubChem CID74764164
Molecular FormulaC8H18MgO
Molecular Weight154.54 g/mol
Exact Mass154.12
IUPAC Name—
SMILESCCCCC(CC)CO.[Mg]
InChIInChI=1S/C8H18O.Mg/c1-3-5-6-8(4-2)7-9;/h8-9H,3-7H2,1-2H3;
InChIKeyWVWIZJDEQLMIQA-UHFFFAOYSA-N
XLogP1.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.54
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethylhexan-1-ol;hydron
CID 175010288
2-ethylhexan-1-ol;iron
CID 22477032
CID 159249113
CID 159249113
2-ethylhexan-1-ol;zirconium;trihydrochloride
CID 173397810
2-ethylhexan-1-ol;trichlorotitanium
CID 22251739
2-ethylhexan-1-ol;2-hexyloctan-1-ol
CID 146216303
2-ethyldodecan-1-ol
CID 545553
ethane-1,2-diol;2-ethylhexan-1-ol;prop-1-ene
CID 139528593
bis(butan-1-ol);ethanol;2-ethylhexan-1-ol;methanol;propan-1-ol;trihydrate
CID 158610217
butanedioic acid;2-ethylhexan-1-ol
CID 159770263
sodium;2-ethylhexan-1-ol;sulfate
CID 20976016
hexakis(dimethylazanide);2-ethylhexan-1-ol;hexan-1-ol;bis(titanium(3+))
CID 173312153

Frequently Asked Questions

What is the IUPAC name of 1-Hexanol, 2-ethyl-, magnesium salt (2:1)?
The IUPAC name of 1-Hexanol, 2-ethyl-, magnesium salt (2:1) (CID 74764164) is not available.
What is the SMILES notation for 1-Hexanol, 2-ethyl-, magnesium salt (2:1)?
The canonical SMILES for 1-Hexanol, 2-ethyl-, magnesium salt (2:1) is CCCCC(CC)CO.[Mg].
What is the InChIKey of 1-Hexanol, 2-ethyl-, magnesium salt (2:1)?
The InChIKey is WVWIZJDEQLMIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.Mg/c1-3-5-6-8(4-2)7-9;/h8-9H,3-7H2,1-2H3;.
What are the key properties of 1-Hexanol, 2-ethyl-, magnesium salt (2:1)?
1-Hexanol, 2-ethyl-, magnesium salt (2:1) has a molecular weight of 154.54 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Hexanol, 2-ethyl-, magnesium salt (2:1) is sourced from PubChem (CID 74764164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).