(2-bromo-4,6-dichlorophenoxy)-trimethylsilane

C9H11BrCl2OSi — CID 14496882

IUPAC(2-bromo-4,6-dichlorophenoxy)-trimethylsilane
SMILESC[Si](C)(C)Oc1c(Cl)cc(Cl)cc1Br
InChIInChI=1S/C9H11BrCl2OSi/c1-14(2,3)13-9-7(10)4-6(11)5-8(9)12/h4-5H,1-3H3
InChIKeyRABZADINRAEICD-UHFFFAOYSA-N
MW314.08 g/mol
LogP4.97
Rot. Bonds2

About (2-bromo-4,6-dichlorophenoxy)-trimethylsilane

(2-bromo-4,6-dichlorophenoxy)-trimethylsilane (PubChem CID 14496882) has the molecular formula C9H11BrCl2OSi and a molecular weight of 314.08 g/mol. Its IUPAC name is (2-bromo-4,6-dichlorophenoxy)-trimethylsilane.

Molecular Properties

Compound Name(2-bromo-4,6-dichlorophenoxy)-trimethylsilane
PubChem CID14496882
Molecular FormulaC9H11BrCl2OSi
Molecular Weight314.08 g/mol
Exact Mass311.91
IUPAC Name(2-bromo-4,6-dichlorophenoxy)-trimethylsilane
SMILESC[Si](C)(C)Oc1c(Cl)cc(Cl)cc1Br
InChIInChI=1S/C9H11BrCl2OSi/c1-14(2,3)13-9-7(10)4-6(11)5-8(9)12/h4-5H,1-3H3
InChIKeyRABZADINRAEICD-UHFFFAOYSA-N
XLogP4.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.08
LogP ≤ 54.97
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 (2-bromo-4,6-dichlorophenoxy)-trimethylsilane?
The IUPAC name of (2-bromo-4,6-dichlorophenoxy)-trimethylsilane (CID 14496882) is (2-bromo-4,6-dichlorophenoxy)-trimethylsilane.
What is the SMILES notation for (2-bromo-4,6-dichlorophenoxy)-trimethylsilane?
The canonical SMILES for (2-bromo-4,6-dichlorophenoxy)-trimethylsilane is C[Si](C)(C)Oc1c(Cl)cc(Cl)cc1Br.
What is the InChIKey of (2-bromo-4,6-dichlorophenoxy)-trimethylsilane?
The InChIKey is RABZADINRAEICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrCl2OSi/c1-14(2,3)13-9-7(10)4-6(11)5-8(9)12/h4-5H,1-3H3.
What are the key properties of (2-bromo-4,6-dichlorophenoxy)-trimethylsilane?
(2-bromo-4,6-dichlorophenoxy)-trimethylsilane has a molecular weight of 314.08 g/mol, XLogP of 4.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4,6-dichlorophenoxy)-trimethylsilane is sourced from PubChem (CID 14496882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).