magnesium;carbanide;ethoxyethane;iodide

C5H13IMgO — CID 87215200

IUPACmagnesium;carbanide;ethoxyethane;iodide
SMILESCCOCC.[CH3-].[I-].[Mg+2]
InChIInChI=1S/C4H10O.CH3.HI.Mg/c1-3-5-4-2;;;/h3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1
InChIKeyKNHSDWASCPWPFM-UHFFFAOYSA-M
MW240.37 g/mol
LogP-1.88
Rot. Bonds2

About magnesium;carbanide;ethoxyethane;iodide

magnesium;carbanide;ethoxyethane;iodide (PubChem CID 87215200) has the molecular formula C5H13IMgO and a molecular weight of 240.37 g/mol. Its IUPAC name is magnesium;carbanide;ethoxyethane;iodide.

Molecular Properties

Compound Namemagnesium;carbanide;ethoxyethane;iodide
PubChem CID87215200
Molecular FormulaC5H13IMgO
Molecular Weight240.37 g/mol
Exact Mass239.99
IUPAC Namemagnesium;carbanide;ethoxyethane;iodide
SMILESCCOCC.[CH3-].[I-].[Mg+2]
InChIInChI=1S/C4H10O.CH3.HI.Mg/c1-3-5-4-2;;;/h3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1
InChIKeyKNHSDWASCPWPFM-UHFFFAOYSA-M
XLogP-1.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 5-1.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of magnesium;carbanide;ethoxyethane;iodide?
The IUPAC name of magnesium;carbanide;ethoxyethane;iodide (CID 87215200) is magnesium;carbanide;ethoxyethane;iodide.
What is the SMILES notation for magnesium;carbanide;ethoxyethane;iodide?
The canonical SMILES for magnesium;carbanide;ethoxyethane;iodide is CCOCC.[CH3-].[I-].[Mg+2].
What is the InChIKey of magnesium;carbanide;ethoxyethane;iodide?
The InChIKey is KNHSDWASCPWPFM-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H10O.CH3.HI.Mg/c1-3-5-4-2;;;/h3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1.
What are the key properties of magnesium;carbanide;ethoxyethane;iodide?
magnesium;carbanide;ethoxyethane;iodide has a molecular weight of 240.37 g/mol, XLogP of -1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;carbanide;ethoxyethane;iodide is sourced from PubChem (CID 87215200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).