(2-Chloroethyl)(methyl)phenylsilane

C9H12ClSi — CID 57148394

IUPAC—
SMILESC[Si](CCCl)c1ccccc1
InChIInChI=1S/C9H12ClSi/c1-11(8-7-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKeyFNLLGKVIXKPKLT-UHFFFAOYSA-N
MW183.73 g/mol
LogP2.26
Rot. Bonds3

About (2-Chloroethyl)(methyl)phenylsilane

(2-Chloroethyl)(methyl)phenylsilane (PubChem CID 57148394) has the molecular formula C9H12ClSi and a molecular weight of 183.73 g/mol.

Molecular Properties

Compound Name(2-Chloroethyl)(methyl)phenylsilane
PubChem CID57148394
Molecular FormulaC9H12ClSi
Molecular Weight183.73 g/mol
Exact Mass183.04
IUPAC Name—
SMILESC[Si](CCCl)c1ccccc1
InChIInChI=1S/C9H12ClSi/c1-11(8-7-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKeyFNLLGKVIXKPKLT-UHFFFAOYSA-N
XLogP2.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.73
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 (2-Chloroethyl)(methyl)phenylsilane?
The IUPAC name of (2-Chloroethyl)(methyl)phenylsilane (CID 57148394) is not available.
What is the SMILES notation for (2-Chloroethyl)(methyl)phenylsilane?
The canonical SMILES for (2-Chloroethyl)(methyl)phenylsilane is C[Si](CCCl)c1ccccc1.
What is the InChIKey of (2-Chloroethyl)(methyl)phenylsilane?
The InChIKey is FNLLGKVIXKPKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClSi/c1-11(8-7-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3.
What are the key properties of (2-Chloroethyl)(methyl)phenylsilane?
(2-Chloroethyl)(methyl)phenylsilane has a molecular weight of 183.73 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-Chloroethyl)(methyl)phenylsilane is sourced from PubChem (CID 57148394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).