magnesium;carbanide;pentane;hydrobromide

C6H15BrMg — CID 118089273

IUPACmagnesium;carbanide;pentane;hydrobromide
SMILESBr.[CH2-]CCCC.[CH3-].[Mg+2]
InChIInChI=1S/C5H11.CH3.BrH.Mg/c1-3-5-4-2;;;/h1,3-5H2,2H3;1H3;1H;/q2*-1;;+2
InChIKeyKWVWQLBYFDRODI-UHFFFAOYSA-N
MW191.39 g/mol
LogP2.66
Rot. Bonds2

About magnesium;carbanide;pentane;hydrobromide

magnesium;carbanide;pentane;hydrobromide (PubChem CID 118089273) has the molecular formula C6H15BrMg and a molecular weight of 191.39 g/mol. Its IUPAC name is magnesium;carbanide;pentane;hydrobromide.

Molecular Properties

Compound Namemagnesium;carbanide;pentane;hydrobromide
PubChem CID118089273
Molecular FormulaC6H15BrMg
Molecular Weight191.39 g/mol
Exact Mass190.02
IUPAC Namemagnesium;carbanide;pentane;hydrobromide
SMILESBr.[CH2-]CCCC.[CH3-].[Mg+2]
InChIInChI=1S/C5H11.CH3.BrH.Mg/c1-3-5-4-2;;;/h1,3-5H2,2H3;1H3;1H;/q2*-1;;+2
InChIKeyKWVWQLBYFDRODI-UHFFFAOYSA-N
XLogP2.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.39
LogP ≤ 52.66
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;carbanide;pentane;hydrobromide?
The IUPAC name of magnesium;carbanide;pentane;hydrobromide (CID 118089273) is magnesium;carbanide;pentane;hydrobromide.
What is the SMILES notation for magnesium;carbanide;pentane;hydrobromide?
The canonical SMILES for magnesium;carbanide;pentane;hydrobromide is Br.[CH2-]CCCC.[CH3-].[Mg+2].
What is the InChIKey of magnesium;carbanide;pentane;hydrobromide?
The InChIKey is KWVWQLBYFDRODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11.CH3.BrH.Mg/c1-3-5-4-2;;;/h1,3-5H2,2H3;1H3;1H;/q2*-1;;+2.
What are the key properties of magnesium;carbanide;pentane;hydrobromide?
magnesium;carbanide;pentane;hydrobromide has a molecular weight of 191.39 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;carbanide;pentane;hydrobromide is sourced from PubChem (CID 118089273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).