magnesium;methanidylcyclohexane;bromide

C7H13BrMg — CID 10932511

IUPACmagnesium;methanidylcyclohexane;bromide
SMILES[Br-].[CH2-]C1CCCCC1.[Mg+2]
InChIInChI=1S/C7H13.BrH.Mg/c1-7-5-3-2-4-6-7;;/h7H,1-6H2;1H;/q-1;;+2/p-1
InChIKeyUFQSTBGEWZUCBQ-UHFFFAOYSA-M
MW201.39 g/mol
LogP-0.98
Rot. Bonds

About magnesium;methanidylcyclohexane;bromide

magnesium;methanidylcyclohexane;bromide (PubChem CID 10932511) has the molecular formula C7H13BrMg and a molecular weight of 201.39 g/mol. Its IUPAC name is magnesium;methanidylcyclohexane;bromide.

Molecular Properties

Compound Namemagnesium;methanidylcyclohexane;bromide
PubChem CID10932511
Molecular FormulaC7H13BrMg
Molecular Weight201.39 g/mol
Exact Mass200.01
IUPAC Namemagnesium;methanidylcyclohexane;bromide
SMILES[Br-].[CH2-]C1CCCCC1.[Mg+2]
InChIInChI=1S/C7H13.BrH.Mg/c1-7-5-3-2-4-6-7;;/h7H,1-6H2;1H;/q-1;;+2/p-1
InChIKeyUFQSTBGEWZUCBQ-UHFFFAOYSA-M
XLogP-0.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.39
LogP ≤ 5-0.98
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;methanidylcyclohexane;bromide?
The IUPAC name of magnesium;methanidylcyclohexane;bromide (CID 10932511) is magnesium;methanidylcyclohexane;bromide.
What is the SMILES notation for magnesium;methanidylcyclohexane;bromide?
The canonical SMILES for magnesium;methanidylcyclohexane;bromide is [Br-].[CH2-]C1CCCCC1.[Mg+2].
What is the InChIKey of magnesium;methanidylcyclohexane;bromide?
The InChIKey is UFQSTBGEWZUCBQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H13.BrH.Mg/c1-7-5-3-2-4-6-7;;/h7H,1-6H2;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;methanidylcyclohexane;bromide?
magnesium;methanidylcyclohexane;bromide has a molecular weight of 201.39 g/mol, XLogP of -0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;methanidylcyclohexane;bromide is sourced from PubChem (CID 10932511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).