(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane

C13H17BrSi — CID 58897750

IUPAC(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane
SMILESCC1=Cc2c(Br)cccc2C1[Si](C)(C)C
InChIInChI=1S/C13H17BrSi/c1-9-8-11-10(6-5-7-12(11)14)13(9)15(2,3)4/h5-8,13H,1-4H3
InChIKeyAWEWXIWTRBQEJZ-UHFFFAOYSA-N
MW281.27 g/mol
LogP4.83
Rot. Bonds1

About (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane

(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane (PubChem CID 58897750) has the molecular formula C13H17BrSi and a molecular weight of 281.27 g/mol. Its IUPAC name is (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane
PubChem CID58897750
Molecular FormulaC13H17BrSi
Molecular Weight281.27 g/mol
Exact Mass280.03
IUPAC Name(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane
SMILESCC1=Cc2c(Br)cccc2C1[Si](C)(C)C
InChIInChI=1S/C13H17BrSi/c1-9-8-11-10(6-5-7-12(11)14)13(9)15(2,3)4/h5-8,13H,1-4H3
InChIKeyAWEWXIWTRBQEJZ-UHFFFAOYSA-N
XLogP4.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 54.83
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-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane?
The IUPAC name of (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane (CID 58897750) is (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane.
What is the SMILES notation for (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane?
The canonical SMILES for (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane is CC1=Cc2c(Br)cccc2C1[Si](C)(C)C.
What is the InChIKey of (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane?
The InChIKey is AWEWXIWTRBQEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17BrSi/c1-9-8-11-10(6-5-7-12(11)14)13(9)15(2,3)4/h5-8,13H,1-4H3.
What are the key properties of (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane?
(4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane has a molecular weight of 281.27 g/mol, XLogP of 4.83, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-methyl-1H-inden-1-yl)-trimethylsilane is sourced from PubChem (CID 58897750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).