magnesium;ethane;chloride;hydrobromide

C2H6BrClMg — CID 135145389

IUPACmagnesium;ethane;chloride;hydrobromide
SMILESBr.[CH2-]C.[Cl-].[Mg+2]
InChIInChI=1S/C2H5.BrH.ClH.Mg/c1-2;;;/h1H2,2H3;2*1H;/q-1;;;+2/p-1
InChIKeyBULQYININHSXOV-UHFFFAOYSA-M
MW169.73 g/mol
LogP-1.96
Rot. Bonds

About magnesium;ethane;chloride;hydrobromide

magnesium;ethane;chloride;hydrobromide (PubChem CID 135145389) has the molecular formula C2H6BrClMg and a molecular weight of 169.73 g/mol. Its IUPAC name is magnesium;ethane;chloride;hydrobromide.

Molecular Properties

Compound Namemagnesium;ethane;chloride;hydrobromide
PubChem CID135145389
Molecular FormulaC2H6BrClMg
Molecular Weight169.73 g/mol
Exact Mass167.92
IUPAC Namemagnesium;ethane;chloride;hydrobromide
SMILESBr.[CH2-]C.[Cl-].[Mg+2]
InChIInChI=1S/C2H5.BrH.ClH.Mg/c1-2;;;/h1H2,2H3;2*1H;/q-1;;;+2/p-1
InChIKeyBULQYININHSXOV-UHFFFAOYSA-M
XLogP-1.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.73
LogP ≤ 5-1.96
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;ethane;chloride;hydrobromide?
The IUPAC name of magnesium;ethane;chloride;hydrobromide (CID 135145389) is magnesium;ethane;chloride;hydrobromide.
What is the SMILES notation for magnesium;ethane;chloride;hydrobromide?
The canonical SMILES for magnesium;ethane;chloride;hydrobromide is Br.[CH2-]C.[Cl-].[Mg+2].
What is the InChIKey of magnesium;ethane;chloride;hydrobromide?
The InChIKey is BULQYININHSXOV-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5.BrH.ClH.Mg/c1-2;;;/h1H2,2H3;2*1H;/q-1;;;+2/p-1.
What are the key properties of magnesium;ethane;chloride;hydrobromide?
magnesium;ethane;chloride;hydrobromide has a molecular weight of 169.73 g/mol, XLogP of -1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;ethane;chloride;hydrobromide is sourced from PubChem (CID 135145389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).