chloro-methyl-oct-7-enyl-phenylsilane

C15H23ClSi — CID 54527858

IUPACchloro-methyl-oct-7-enyl-phenylsilane
SMILESC=CCCCCCC[Si](C)(Cl)c1ccccc1
InChIInChI=1S/C15H23ClSi/c1-3-4-5-6-7-11-14-17(2,16)15-12-9-8-10-13-15/h3,8-10,12-13H,1,4-7,11,14H2,2H3
InChIKeyYUJKDOPCADTOJQ-UHFFFAOYSA-N
MW266.89 g/mol
LogP4.84
Rot. Bonds8

About chloro-methyl-oct-7-enyl-phenylsilane

chloro-methyl-oct-7-enyl-phenylsilane (PubChem CID 54527858) has the molecular formula C15H23ClSi and a molecular weight of 266.89 g/mol. Its IUPAC name is chloro-methyl-oct-7-enyl-phenylsilane.

Molecular Properties

Compound Namechloro-methyl-oct-7-enyl-phenylsilane
PubChem CID54527858
Molecular FormulaC15H23ClSi
Molecular Weight266.89 g/mol
Exact Mass266.13
IUPAC Namechloro-methyl-oct-7-enyl-phenylsilane
SMILESC=CCCCCCC[Si](C)(Cl)c1ccccc1
InChIInChI=1S/C15H23ClSi/c1-3-4-5-6-7-11-14-17(2,16)15-12-9-8-10-13-15/h3,8-10,12-13H,1,4-7,11,14H2,2H3
InChIKeyYUJKDOPCADTOJQ-UHFFFAOYSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.89
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze chloro-methyl-oct-7-enyl-phenylsilane 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 chloro-methyl-oct-7-enyl-phenylsilane?
The IUPAC name of chloro-methyl-oct-7-enyl-phenylsilane (CID 54527858) is chloro-methyl-oct-7-enyl-phenylsilane.
What is the SMILES notation for chloro-methyl-oct-7-enyl-phenylsilane?
The canonical SMILES for chloro-methyl-oct-7-enyl-phenylsilane is C=CCCCCCC[Si](C)(Cl)c1ccccc1.
What is the InChIKey of chloro-methyl-oct-7-enyl-phenylsilane?
The InChIKey is YUJKDOPCADTOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClSi/c1-3-4-5-6-7-11-14-17(2,16)15-12-9-8-10-13-15/h3,8-10,12-13H,1,4-7,11,14H2,2H3.
What are the key properties of chloro-methyl-oct-7-enyl-phenylsilane?
chloro-methyl-oct-7-enyl-phenylsilane has a molecular weight of 266.89 g/mol, XLogP of 4.84, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-methyl-oct-7-enyl-phenylsilane is sourced from PubChem (CID 54527858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).