12-bromododecyl(trimethyl)silane

C15H33BrSi — CID 86200822

IUPAC12-bromododecyl(trimethyl)silane
SMILESC[Si](C)(C)CCCCCCCCCCCCBr
InChIInChI=1S/C15H33BrSi/c1-17(2,3)15-13-11-9-7-5-4-6-8-10-12-14-16/h4-15H2,1-3H3
InChIKeyGSNDFSJCOBUMOU-UHFFFAOYSA-N
MW321.42 g/mol
LogP6.62
Rot. Bonds12

About 12-bromododecyl(trimethyl)silane

12-bromododecyl(trimethyl)silane (PubChem CID 86200822) has the molecular formula C15H33BrSi and a molecular weight of 321.42 g/mol. Its IUPAC name is 12-bromododecyl(trimethyl)silane.

Molecular Properties

Compound Name12-bromododecyl(trimethyl)silane
PubChem CID86200822
Molecular FormulaC15H33BrSi
Molecular Weight321.42 g/mol
Exact Mass320.15
IUPAC Name12-bromododecyl(trimethyl)silane
SMILESC[Si](C)(C)CCCCCCCCCCCCBr
InChIInChI=1S/C15H33BrSi/c1-17(2,3)15-13-11-9-7-5-4-6-8-10-12-14-16/h4-15H2,1-3H3
InChIKeyGSNDFSJCOBUMOU-UHFFFAOYSA-N
XLogP6.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.42
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 12-bromododecyl(trimethyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 12-bromododecyl(trimethyl)silane?
The IUPAC name of 12-bromododecyl(trimethyl)silane (CID 86200822) is 12-bromododecyl(trimethyl)silane.
What is the SMILES notation for 12-bromododecyl(trimethyl)silane?
The canonical SMILES for 12-bromododecyl(trimethyl)silane is C[Si](C)(C)CCCCCCCCCCCCBr.
What is the InChIKey of 12-bromododecyl(trimethyl)silane?
The InChIKey is GSNDFSJCOBUMOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33BrSi/c1-17(2,3)15-13-11-9-7-5-4-6-8-10-12-14-16/h4-15H2,1-3H3.
What are the key properties of 12-bromododecyl(trimethyl)silane?
12-bromododecyl(trimethyl)silane has a molecular weight of 321.42 g/mol, XLogP of 6.62, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 12-bromododecyl(trimethyl)silane is sourced from PubChem (CID 86200822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).