dimagnesium;carbanide;dibromide;hydrate

C2H8Br2Mg2O — CID 22502526

IUPACdimagnesium;carbanide;dibromide;hydrate
SMILESO.[Br-].[Br-].[CH3-].[CH3-].[Mg+2].[Mg+2]
InChIInChI=1S/2CH3.2BrH.2Mg.H2O/h2*1H3;2*1H;;;1H2/q2*-1;;;2*+2;/p-2
InChIKeyYUAGBTJOJYJKFX-UHFFFAOYSA-L
MW256.50 g/mol
LogP-6.68
Rot. Bonds

About dimagnesium;carbanide;dibromide;hydrate

dimagnesium;carbanide;dibromide;hydrate (PubChem CID 22502526) has the molecular formula C2H8Br2Mg2O and a molecular weight of 256.50 g/mol. Its IUPAC name is dimagnesium;carbanide;dibromide;hydrate.

Molecular Properties

Compound Namedimagnesium;carbanide;dibromide;hydrate
PubChem CID22502526
Molecular FormulaC2H8Br2Mg2O
Molecular Weight256.50 g/mol
Exact Mass253.86
IUPAC Namedimagnesium;carbanide;dibromide;hydrate
SMILESO.[Br-].[Br-].[CH3-].[CH3-].[Mg+2].[Mg+2]
InChIInChI=1S/2CH3.2BrH.2Mg.H2O/h2*1H3;2*1H;;;1H2/q2*-1;;;2*+2;/p-2
InChIKeyYUAGBTJOJYJKFX-UHFFFAOYSA-L
XLogP-6.68
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.50
LogP ≤ 5-6.68
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 dimagnesium;carbanide;dibromide;hydrate?
The IUPAC name of dimagnesium;carbanide;dibromide;hydrate (CID 22502526) is dimagnesium;carbanide;dibromide;hydrate.
What is the SMILES notation for dimagnesium;carbanide;dibromide;hydrate?
The canonical SMILES for dimagnesium;carbanide;dibromide;hydrate is O.[Br-].[Br-].[CH3-].[CH3-].[Mg+2].[Mg+2].
What is the InChIKey of dimagnesium;carbanide;dibromide;hydrate?
The InChIKey is YUAGBTJOJYJKFX-UHFFFAOYSA-L. The full InChI is InChI=1S/2CH3.2BrH.2Mg.H2O/h2*1H3;2*1H;;;1H2/q2*-1;;;2*+2;/p-2.
What are the key properties of dimagnesium;carbanide;dibromide;hydrate?
dimagnesium;carbanide;dibromide;hydrate has a molecular weight of 256.50 g/mol, XLogP of -6.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimagnesium;carbanide;dibromide;hydrate is sourced from PubChem (CID 22502526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).