CID 71328915

C6H14MgO — CID 71328915

IUPAC—
SMILESCCOCC(C)C.[Mg]
InChIInChI=1S/C6H14O.Mg/c1-4-7-5-6(2)3;/h6H,4-5H2,1-3H3;
InChIKeyCSWDIWIWKZRIFN-UHFFFAOYSA-N
MW126.48 g/mol
LogP1.30
Rot. Bonds3

About CID 71328915

CID 71328915 (PubChem CID 71328915) has the molecular formula C6H14MgO and a molecular weight of 126.48 g/mol.

Molecular Properties

Compound NameCID 71328915
PubChem CID71328915
Molecular FormulaC6H14MgO
Molecular Weight126.48 g/mol
Exact Mass126.09
IUPAC Name—
SMILESCCOCC(C)C.[Mg]
InChIInChI=1S/C6H14O.Mg/c1-4-7-5-6(2)3;/h6H,4-5H2,1-3H3;
InChIKeyCSWDIWIWKZRIFN-UHFFFAOYSA-N
XLogP1.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.48
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 71328915?
The IUPAC name of CID 71328915 (CID 71328915) is not available.
What is the SMILES notation for CID 71328915?
The canonical SMILES for CID 71328915 is CCOCC(C)C.[Mg].
What is the InChIKey of CID 71328915?
The InChIKey is CSWDIWIWKZRIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O.Mg/c1-4-7-5-6(2)3;/h6H,4-5H2,1-3H3;.
What are the key properties of CID 71328915?
CID 71328915 has a molecular weight of 126.48 g/mol, XLogP of 1.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 71328915 is sourced from PubChem (CID 71328915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).