(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane

C8H11BrClNSi — CID 71419940

IUPAC(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane
SMILESC[Si](C)(C)c1ccnc(Cl)c1Br
InChIInChI=1S/C8H11BrClNSi/c1-12(2,3)6-4-5-11-8(10)7(6)9/h4-5H,1-3H3
InChIKeyRIAXSQLNEHBWJV-UHFFFAOYSA-N
MW264.63 g/mol
LogP3.04
Rot. Bonds1

About (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane

(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane (PubChem CID 71419940) has the molecular formula C8H11BrClNSi and a molecular weight of 264.63 g/mol. Its IUPAC name is (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane.

Molecular Properties

Compound Name(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane
PubChem CID71419940
Molecular FormulaC8H11BrClNSi
Molecular Weight264.63 g/mol
Exact Mass262.95
IUPAC Name(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane
SMILESC[Si](C)(C)c1ccnc(Cl)c1Br
InChIInChI=1S/C8H11BrClNSi/c1-12(2,3)6-4-5-11-8(10)7(6)9/h4-5H,1-3H3
InChIKeyRIAXSQLNEHBWJV-UHFFFAOYSA-N
XLogP3.04
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.63
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane?
The IUPAC name of (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane (CID 71419940) is (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane.
What is the SMILES notation for (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane?
The canonical SMILES for (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane is C[Si](C)(C)c1ccnc(Cl)c1Br.
What is the InChIKey of (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane?
The InChIKey is RIAXSQLNEHBWJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrClNSi/c1-12(2,3)6-4-5-11-8(10)7(6)9/h4-5H,1-3H3.
What are the key properties of (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane?
(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane has a molecular weight of 264.63 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-2-chloro-4-pyridinyl)-trimethylsilane is sourced from PubChem (CID 71419940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).