magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane

C14H30Mg — CID 150170655

IUPACmagnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane
SMILESCC[C-](C(C)(C)C)C(C)(C)C.[CH2-]CC.[Mg+2]
InChIInChI=1S/C11H23.C3H7.Mg/c1-8-9(10(2,3)4)11(5,6)7;1-3-2;/h8H2,1-7H3;1,3H2,2H3;/q2*-1;+2
InChIKeyUSHNOLVTZIWSGA-UHFFFAOYSA-N
MW222.70 g/mol
LogP4.91
Rot. Bonds1

About magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane

magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane (PubChem CID 150170655) has the molecular formula C14H30Mg and a molecular weight of 222.70 g/mol. Its IUPAC name is magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane.

Molecular Properties

Compound Namemagnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane
PubChem CID150170655
Molecular FormulaC14H30Mg
Molecular Weight222.70 g/mol
Exact Mass222.22
IUPAC Namemagnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane
SMILESCC[C-](C(C)(C)C)C(C)(C)C.[CH2-]CC.[Mg+2]
InChIInChI=1S/C11H23.C3H7.Mg/c1-8-9(10(2,3)4)11(5,6)7;1-3-2;/h8H2,1-7H3;1,3H2,2H3;/q2*-1;+2
InChIKeyUSHNOLVTZIWSGA-UHFFFAOYSA-N
XLogP4.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.70
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane?
The IUPAC name of magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane (CID 150170655) is magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane.
What is the SMILES notation for magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane?
The canonical SMILES for magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane is CC[C-](C(C)(C)C)C(C)(C)C.[CH2-]CC.[Mg+2].
What is the InChIKey of magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane?
The InChIKey is USHNOLVTZIWSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23.C3H7.Mg/c1-8-9(10(2,3)4)11(5,6)7;1-3-2;/h8H2,1-7H3;1,3H2,2H3;/q2*-1;+2.
What are the key properties of magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane?
magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane has a molecular weight of 222.70 g/mol, XLogP of 4.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;3-ethyl-2,2,4,4-tetramethylpentane;propane is sourced from PubChem (CID 150170655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).