chloro-hexyl-dimethylsilane

C8H19ClSi — CID 2733540

IUPACchloro-hexyl-dimethylsilane
SMILESCCCCCC[Si](C)(C)Cl
InChIInChI=1S/C8H19ClSi/c1-4-5-6-7-8-10(2,3)9/h4-8H2,1-3H3
InChIKeyJQYKSDDVPXVEOL-UHFFFAOYSA-N
MW178.78 g/mol
LogP4.01
Rot. Bonds5

About chloro-hexyl-dimethylsilane

chloro-hexyl-dimethylsilane (PubChem CID 2733540) has the molecular formula C8H19ClSi and a molecular weight of 178.78 g/mol. Its IUPAC name is chloro-hexyl-dimethylsilane.

Molecular Properties

Compound Namechloro-hexyl-dimethylsilane
PubChem CID2733540
Molecular FormulaC8H19ClSi
Molecular Weight178.78 g/mol
Exact Mass178.09
IUPAC Namechloro-hexyl-dimethylsilane
SMILESCCCCCC[Si](C)(C)Cl
InChIInChI=1S/C8H19ClSi/c1-4-5-6-7-8-10(2,3)9/h4-8H2,1-3H3
InChIKeyJQYKSDDVPXVEOL-UHFFFAOYSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.78
LogP ≤ 54.01
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': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-hexyl-dimethylsilane?
The IUPAC name of chloro-hexyl-dimethylsilane (CID 2733540) is chloro-hexyl-dimethylsilane.
What is the SMILES notation for chloro-hexyl-dimethylsilane?
The canonical SMILES for chloro-hexyl-dimethylsilane is CCCCCC[Si](C)(C)Cl.
What is the InChIKey of chloro-hexyl-dimethylsilane?
The InChIKey is JQYKSDDVPXVEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19ClSi/c1-4-5-6-7-8-10(2,3)9/h4-8H2,1-3H3.
What are the key properties of chloro-hexyl-dimethylsilane?
chloro-hexyl-dimethylsilane has a molecular weight of 178.78 g/mol, XLogP of 4.01, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-hexyl-dimethylsilane is sourced from PubChem (CID 2733540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).