(4-bromophenyl)-tert-butyl-dimethylsilane

C12H19BrSi — CID 15446452

IUPAC(4-bromophenyl)-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)c1ccc(Br)cc1
InChIInChI=1S/C12H19BrSi/c1-12(2,3)14(4,5)11-8-6-10(13)7-9-11/h6-9H,1-5H3
InChIKeyWNRRKAWIXFXGAU-UHFFFAOYSA-N
MW271.27 g/mol
LogP4.16
Rot. Bonds1

About (4-bromophenyl)-tert-butyl-dimethylsilane

(4-bromophenyl)-tert-butyl-dimethylsilane (PubChem CID 15446452) has the molecular formula C12H19BrSi and a molecular weight of 271.27 g/mol. Its IUPAC name is (4-bromophenyl)-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name(4-bromophenyl)-tert-butyl-dimethylsilane
PubChem CID15446452
Molecular FormulaC12H19BrSi
Molecular Weight271.27 g/mol
Exact Mass270.04
IUPAC Name(4-bromophenyl)-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)c1ccc(Br)cc1
InChIInChI=1S/C12H19BrSi/c1-12(2,3)14(4,5)11-8-6-10(13)7-9-11/h6-9H,1-5H3
InChIKeyWNRRKAWIXFXGAU-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (4-bromophenyl)-tert-butyl-dimethylsilane?
The IUPAC name of (4-bromophenyl)-tert-butyl-dimethylsilane (CID 15446452) is (4-bromophenyl)-tert-butyl-dimethylsilane.
What is the SMILES notation for (4-bromophenyl)-tert-butyl-dimethylsilane?
The canonical SMILES for (4-bromophenyl)-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)c1ccc(Br)cc1.
What is the InChIKey of (4-bromophenyl)-tert-butyl-dimethylsilane?
The InChIKey is WNRRKAWIXFXGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19BrSi/c1-12(2,3)14(4,5)11-8-6-10(13)7-9-11/h6-9H,1-5H3.
What are the key properties of (4-bromophenyl)-tert-butyl-dimethylsilane?
(4-bromophenyl)-tert-butyl-dimethylsilane has a molecular weight of 271.27 g/mol, XLogP of 4.16, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-tert-butyl-dimethylsilane is sourced from PubChem (CID 15446452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).