magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide

C9H24BrMgOSi+ — CID 173031792

IUPACmagnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide
SMILESBr.CC(C)(C)[Si](C)(C)O.[CH2-]CC.[Mg+2]
InChIInChI=1S/C6H16OSi.C3H7.BrH.Mg/c1-6(2,3)8(4,5)7;1-3-2;;/h7H,1-5H3;1,3H2,2H3;1H;/q;-1;;+2
InChIKeyQILCKGBGYCFNLL-UHFFFAOYSA-N
MW280.59 g/mol
LogP3.41
Rot. Bonds

About magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide

magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide (PubChem CID 173031792) has the molecular formula C9H24BrMgOSi+ and a molecular weight of 280.59 g/mol. Its IUPAC name is magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide.

Molecular Properties

Compound Namemagnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide
PubChem CID173031792
Molecular FormulaC9H24BrMgOSi+
Molecular Weight280.59 g/mol
Exact Mass279.06
IUPAC Namemagnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide
SMILESBr.CC(C)(C)[Si](C)(C)O.[CH2-]CC.[Mg+2]
InChIInChI=1S/C6H16OSi.C3H7.BrH.Mg/c1-6(2,3)8(4,5)7;1-3-2;;/h7H,1-5H3;1,3H2,2H3;1H;/q;-1;;+2
InChIKeyQILCKGBGYCFNLL-UHFFFAOYSA-N
XLogP3.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.59
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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magnesium;ethanolate;tetramethylsilane
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CID 10975296
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CID 71403721
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CID 134905882

Frequently Asked Questions

What is the IUPAC name of magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide?
The IUPAC name of magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide (CID 173031792) is magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide.
What is the SMILES notation for magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide?
The canonical SMILES for magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide is Br.CC(C)(C)[Si](C)(C)O.[CH2-]CC.[Mg+2].
What is the InChIKey of magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide?
The InChIKey is QILCKGBGYCFNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16OSi.C3H7.BrH.Mg/c1-6(2,3)8(4,5)7;1-3-2;;/h7H,1-5H3;1,3H2,2H3;1H;/q;-1;;+2.
What are the key properties of magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide?
magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide has a molecular weight of 280.59 g/mol, XLogP of 3.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;tert-butyl-hydroxy-dimethylsilane;propane;hydrobromide is sourced from PubChem (CID 173031792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).