dimethylchlorooctadecylsilane

C20H42ClSi — CID 87368573

IUPAC—
SMILESC[Si](C)CCCCCCCCCCCCCCCCCCCl
InChIInChI=1S/C20H42ClSi/c1-22(2)20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21/h3-20H2,1-2H3
InChIKeyRNYSNYBOKQBHDO-UHFFFAOYSA-N
MW346.10 g/mol
LogP8.22
Rot. Bonds18

About dimethylchlorooctadecylsilane

dimethylchlorooctadecylsilane (PubChem CID 87368573) has the molecular formula C20H42ClSi and a molecular weight of 346.10 g/mol.

Molecular Properties

Compound Namedimethylchlorooctadecylsilane
PubChem CID87368573
Molecular FormulaC20H42ClSi
Molecular Weight346.10 g/mol
Exact Mass345.27
IUPAC Name—
SMILESC[Si](C)CCCCCCCCCCCCCCCCCCCl
InChIInChI=1S/C20H42ClSi/c1-22(2)20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21/h3-20H2,1-2H3
InChIKeyRNYSNYBOKQBHDO-UHFFFAOYSA-N
XLogP8.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.10
LogP ≤ 58.22
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'}

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Frequently Asked Questions

What is the IUPAC name of dimethylchlorooctadecylsilane?
The IUPAC name of dimethylchlorooctadecylsilane (CID 87368573) is not available.
What is the SMILES notation for dimethylchlorooctadecylsilane?
The canonical SMILES for dimethylchlorooctadecylsilane is C[Si](C)CCCCCCCCCCCCCCCCCCCl.
What is the InChIKey of dimethylchlorooctadecylsilane?
The InChIKey is RNYSNYBOKQBHDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42ClSi/c1-22(2)20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21/h3-20H2,1-2H3.
What are the key properties of dimethylchlorooctadecylsilane?
dimethylchlorooctadecylsilane has a molecular weight of 346.10 g/mol, XLogP of 8.22, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylchlorooctadecylsilane is sourced from PubChem (CID 87368573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).