butyl-chloro-ethenyl-phenylsilane

C12H17ClSi — CID 67342810

IUPACbutyl-chloro-ethenyl-phenylsilane
SMILESC=C[Si](Cl)(CCCC)c1ccccc1
InChIInChI=1S/C12H17ClSi/c1-3-5-11-14(13,4-2)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11H2,1H3
InChIKeyGFMOKPJIMNXCOL-UHFFFAOYSA-N
MW224.81 g/mol
LogP3.60
Rot. Bonds5

About butyl-chloro-ethenyl-phenylsilane

butyl-chloro-ethenyl-phenylsilane (PubChem CID 67342810) has the molecular formula C12H17ClSi and a molecular weight of 224.81 g/mol. Its IUPAC name is butyl-chloro-ethenyl-phenylsilane.

Molecular Properties

Compound Namebutyl-chloro-ethenyl-phenylsilane
PubChem CID67342810
Molecular FormulaC12H17ClSi
Molecular Weight224.81 g/mol
Exact Mass224.08
IUPAC Namebutyl-chloro-ethenyl-phenylsilane
SMILESC=C[Si](Cl)(CCCC)c1ccccc1
InChIInChI=1S/C12H17ClSi/c1-3-5-11-14(13,4-2)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11H2,1H3
InChIKeyGFMOKPJIMNXCOL-UHFFFAOYSA-N
XLogP3.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.81
LogP ≤ 53.60
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 butyl-chloro-ethenyl-phenylsilane?
The IUPAC name of butyl-chloro-ethenyl-phenylsilane (CID 67342810) is butyl-chloro-ethenyl-phenylsilane.
What is the SMILES notation for butyl-chloro-ethenyl-phenylsilane?
The canonical SMILES for butyl-chloro-ethenyl-phenylsilane is C=C[Si](Cl)(CCCC)c1ccccc1.
What is the InChIKey of butyl-chloro-ethenyl-phenylsilane?
The InChIKey is GFMOKPJIMNXCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClSi/c1-3-5-11-14(13,4-2)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11H2,1H3.
What are the key properties of butyl-chloro-ethenyl-phenylsilane?
butyl-chloro-ethenyl-phenylsilane has a molecular weight of 224.81 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-chloro-ethenyl-phenylsilane is sourced from PubChem (CID 67342810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).