(chloromethyl)dimethylallylsilane

C6H11ClSi — CID 87974137

IUPAC—
SMILESCC(C)=CC[Si]CCl
InChIInChI=1S/C6H11ClSi/c1-6(2)3-4-8-5-7/h3H,4-5H2,1-2H3
InChIKeyRCFJTDXWZIPSRY-UHFFFAOYSA-N
MW146.69 g/mol
LogP2.27
Rot. Bonds3

About (chloromethyl)dimethylallylsilane

(chloromethyl)dimethylallylsilane (PubChem CID 87974137) has the molecular formula C6H11ClSi and a molecular weight of 146.69 g/mol.

Molecular Properties

Compound Name(chloromethyl)dimethylallylsilane
PubChem CID87974137
Molecular FormulaC6H11ClSi
Molecular Weight146.69 g/mol
Exact Mass146.03
IUPAC Name—
SMILESCC(C)=CC[Si]CCl
InChIInChI=1S/C6H11ClSi/c1-6(2)3-4-8-5-7/h3H,4-5H2,1-2H3
InChIKeyRCFJTDXWZIPSRY-UHFFFAOYSA-N
XLogP2.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.69
LogP ≤ 52.27
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (chloromethyl)dimethylallylsilane?
The IUPAC name of (chloromethyl)dimethylallylsilane (CID 87974137) is not available.
What is the SMILES notation for (chloromethyl)dimethylallylsilane?
The canonical SMILES for (chloromethyl)dimethylallylsilane is CC(C)=CC[Si]CCl.
What is the InChIKey of (chloromethyl)dimethylallylsilane?
The InChIKey is RCFJTDXWZIPSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11ClSi/c1-6(2)3-4-8-5-7/h3H,4-5H2,1-2H3.
What are the key properties of (chloromethyl)dimethylallylsilane?
(chloromethyl)dimethylallylsilane has a molecular weight of 146.69 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (chloromethyl)dimethylallylsilane is sourced from PubChem (CID 87974137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).