(3-chlorophenoxy)-trimethylsilane

C9H13ClOSi — CID 523559

IUPAC(3-chlorophenoxy)-trimethylsilane
SMILESC[Si](C)(C)Oc1cccc(Cl)c1
InChIInChI=1S/C9H13ClOSi/c1-12(2,3)11-9-6-4-5-8(10)7-9/h4-7H,1-3H3
InChIKeyBFUAFRGEFKDQJD-UHFFFAOYSA-N
MW200.74 g/mol
LogP3.55
Rot. Bonds2

About (3-chlorophenoxy)-trimethylsilane

(3-chlorophenoxy)-trimethylsilane (PubChem CID 523559) has the molecular formula C9H13ClOSi and a molecular weight of 200.74 g/mol. Its IUPAC name is (3-chlorophenoxy)-trimethylsilane.

Molecular Properties

Compound Name(3-chlorophenoxy)-trimethylsilane
PubChem CID523559
Molecular FormulaC9H13ClOSi
Molecular Weight200.74 g/mol
Exact Mass200.04
IUPAC Name(3-chlorophenoxy)-trimethylsilane
SMILESC[Si](C)(C)Oc1cccc(Cl)c1
InChIInChI=1S/C9H13ClOSi/c1-12(2,3)11-9-6-4-5-8(10)7-9/h4-7H,1-3H3
InChIKeyBFUAFRGEFKDQJD-UHFFFAOYSA-N
XLogP3.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.74
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-chlorophenoxy)-trimethylsilane?
The IUPAC name of (3-chlorophenoxy)-trimethylsilane (CID 523559) is (3-chlorophenoxy)-trimethylsilane.
What is the SMILES notation for (3-chlorophenoxy)-trimethylsilane?
The canonical SMILES for (3-chlorophenoxy)-trimethylsilane is C[Si](C)(C)Oc1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenoxy)-trimethylsilane?
The InChIKey is BFUAFRGEFKDQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClOSi/c1-12(2,3)11-9-6-4-5-8(10)7-9/h4-7H,1-3H3.
What are the key properties of (3-chlorophenoxy)-trimethylsilane?
(3-chlorophenoxy)-trimethylsilane has a molecular weight of 200.74 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenoxy)-trimethylsilane is sourced from PubChem (CID 523559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).