magnesium;ethene;fluoromethane;methanimine;hydrobromide

C4H9BrFMgN — CID 88730569

IUPACmagnesium;ethene;fluoromethane;methanimine;hydrobromide
SMILESBr.[CH2-]F.[H]N=C.[H][C-]=C.[Mg+2]
InChIInChI=1S/C2H3.CH2F.CH3N.BrH.Mg/c3*1-2;;/h1H,2H2;1H2;2H,1H2;1H;/q2*-1;;;+2
InChIKeyWLZFNKSEFADULA-UHFFFAOYSA-N
MW194.33 g/mol
LogP1.82
Rot. Bonds

About magnesium;ethene;fluoromethane;methanimine;hydrobromide

magnesium;ethene;fluoromethane;methanimine;hydrobromide (PubChem CID 88730569) has the molecular formula C4H9BrFMgN and a molecular weight of 194.33 g/mol. Its IUPAC name is magnesium;ethene;fluoromethane;methanimine;hydrobromide.

Molecular Properties

Compound Namemagnesium;ethene;fluoromethane;methanimine;hydrobromide
PubChem CID88730569
Molecular FormulaC4H9BrFMgN
Molecular Weight194.33 g/mol
Exact Mass192.98
IUPAC Namemagnesium;ethene;fluoromethane;methanimine;hydrobromide
SMILESBr.[CH2-]F.[H]N=C.[H][C-]=C.[Mg+2]
InChIInChI=1S/C2H3.CH2F.CH3N.BrH.Mg/c3*1-2;;/h1H,2H2;1H2;2H,1H2;1H;/q2*-1;;;+2
InChIKeyWLZFNKSEFADULA-UHFFFAOYSA-N
XLogP1.82
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;ethene;fluoromethane;methanimine;hydrobromide?
The IUPAC name of magnesium;ethene;fluoromethane;methanimine;hydrobromide (CID 88730569) is magnesium;ethene;fluoromethane;methanimine;hydrobromide.
What is the SMILES notation for magnesium;ethene;fluoromethane;methanimine;hydrobromide?
The canonical SMILES for magnesium;ethene;fluoromethane;methanimine;hydrobromide is Br.[CH2-]F.[H]N=C.[H][C-]=C.[Mg+2].
What is the InChIKey of magnesium;ethene;fluoromethane;methanimine;hydrobromide?
The InChIKey is WLZFNKSEFADULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3.CH2F.CH3N.BrH.Mg/c3*1-2;;/h1H,2H2;1H2;2H,1H2;1H;/q2*-1;;;+2.
What are the key properties of magnesium;ethene;fluoromethane;methanimine;hydrobromide?
magnesium;ethene;fluoromethane;methanimine;hydrobromide has a molecular weight of 194.33 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;ethene;fluoromethane;methanimine;hydrobromide is sourced from PubChem (CID 88730569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).