16-bromohexadecyl(trichloro)silane

C16H32BrCl3Si — CID 22259932

IUPAC16-bromohexadecyl(trichloro)silane
SMILESCl[Si](Cl)(Cl)CCCCCCCCCCCCCCCCBr
InChIInChI=1S/C16H32BrCl3Si/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-21(18,19)20/h1-16H2
InChIKeyOCPVJFUMMMBRRF-UHFFFAOYSA-N
MW438.78 g/mol
LogP8.50
Rot. Bonds16

About 16-bromohexadecyl(trichloro)silane

16-bromohexadecyl(trichloro)silane (PubChem CID 22259932) has the molecular formula C16H32BrCl3Si and a molecular weight of 438.78 g/mol. Its IUPAC name is 16-bromohexadecyl(trichloro)silane.

Molecular Properties

Compound Name16-bromohexadecyl(trichloro)silane
PubChem CID22259932
Molecular FormulaC16H32BrCl3Si
Molecular Weight438.78 g/mol
Exact Mass436.05
IUPAC Name16-bromohexadecyl(trichloro)silane
SMILESCl[Si](Cl)(Cl)CCCCCCCCCCCCCCCCBr
InChIInChI=1S/C16H32BrCl3Si/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-21(18,19)20/h1-16H2
InChIKeyOCPVJFUMMMBRRF-UHFFFAOYSA-N
XLogP8.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.78
LogP ≤ 58.50
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 16-bromohexadecyl(trichloro)silane?
The IUPAC name of 16-bromohexadecyl(trichloro)silane (CID 22259932) is 16-bromohexadecyl(trichloro)silane.
What is the SMILES notation for 16-bromohexadecyl(trichloro)silane?
The canonical SMILES for 16-bromohexadecyl(trichloro)silane is Cl[Si](Cl)(Cl)CCCCCCCCCCCCCCCCBr.
What is the InChIKey of 16-bromohexadecyl(trichloro)silane?
The InChIKey is OCPVJFUMMMBRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32BrCl3Si/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-21(18,19)20/h1-16H2.
What are the key properties of 16-bromohexadecyl(trichloro)silane?
16-bromohexadecyl(trichloro)silane has a molecular weight of 438.78 g/mol, XLogP of 8.50, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 16-bromohexadecyl(trichloro)silane is sourced from PubChem (CID 22259932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).