bromo-tris(2-methylpropyl)silane

C12H27BrSi — CID 14736133

IUPACbromo-tris(2-methylpropyl)silane
SMILESCC(C)C[Si](Br)(CC(C)C)CC(C)C
InChIInChI=1S/C12H27BrSi/c1-10(2)7-14(13,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3
InChIKeyGXNLPTXFYRYVDI-UHFFFAOYSA-N
MW279.34 g/mol
LogP5.29
Rot. Bonds6

About bromo-tris(2-methylpropyl)silane

bromo-tris(2-methylpropyl)silane (PubChem CID 14736133) has the molecular formula C12H27BrSi and a molecular weight of 279.34 g/mol. Its IUPAC name is bromo-tris(2-methylpropyl)silane.

Molecular Properties

Compound Namebromo-tris(2-methylpropyl)silane
PubChem CID14736133
Molecular FormulaC12H27BrSi
Molecular Weight279.34 g/mol
Exact Mass278.11
IUPAC Namebromo-tris(2-methylpropyl)silane
SMILESCC(C)C[Si](Br)(CC(C)C)CC(C)C
InChIInChI=1S/C12H27BrSi/c1-10(2)7-14(13,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3
InChIKeyGXNLPTXFYRYVDI-UHFFFAOYSA-N
XLogP5.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.34
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromo-tris(2-methylpropyl)silane?
The IUPAC name of bromo-tris(2-methylpropyl)silane (CID 14736133) is bromo-tris(2-methylpropyl)silane.
What is the SMILES notation for bromo-tris(2-methylpropyl)silane?
The canonical SMILES for bromo-tris(2-methylpropyl)silane is CC(C)C[Si](Br)(CC(C)C)CC(C)C.
What is the InChIKey of bromo-tris(2-methylpropyl)silane?
The InChIKey is GXNLPTXFYRYVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27BrSi/c1-10(2)7-14(13,8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3.
What are the key properties of bromo-tris(2-methylpropyl)silane?
bromo-tris(2-methylpropyl)silane has a molecular weight of 279.34 g/mol, XLogP of 5.29, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-tris(2-methylpropyl)silane is sourced from PubChem (CID 14736133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).