6-bromo-5,5-dimethylindeno[2,1-b]siline

C14H13BrSi — CID 175724983

IUPAC6-bromo-5,5-dimethylindeno[2,1-b]siline
SMILESCC1(C)C(Br)=CC=C2C=c3[siH]cccc3=C21
InChIInChI=1S/C14H13BrSi/c1-14(2)12(15)6-5-9-8-11-10(13(9)14)4-3-7-16-11/h3-8,16H,1-2H3
InChIKeyYAOPLLBMGISYKQ-UHFFFAOYSA-N
MW289.25 g/mol
LogP1.95
Rot. Bonds

About 6-bromo-5,5-dimethylindeno[2,1-b]siline

6-bromo-5,5-dimethylindeno[2,1-b]siline (PubChem CID 175724983) has the molecular formula C14H13BrSi and a molecular weight of 289.25 g/mol. Its IUPAC name is 6-bromo-5,5-dimethylindeno[2,1-b]siline.

Molecular Properties

Compound Name6-bromo-5,5-dimethylindeno[2,1-b]siline
PubChem CID175724983
Molecular FormulaC14H13BrSi
Molecular Weight289.25 g/mol
Exact Mass288.00
IUPAC Name6-bromo-5,5-dimethylindeno[2,1-b]siline
SMILESCC1(C)C(Br)=CC=C2C=c3[siH]cccc3=C21
InChIInChI=1S/C14H13BrSi/c1-14(2)12(15)6-5-9-8-11-10(13(9)14)4-3-7-16-11/h3-8,16H,1-2H3
InChIKeyYAOPLLBMGISYKQ-UHFFFAOYSA-N
XLogP1.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.25
LogP ≤ 51.95
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 6-bromo-5,5-dimethylindeno[2,1-b]siline?
The IUPAC name of 6-bromo-5,5-dimethylindeno[2,1-b]siline (CID 175724983) is 6-bromo-5,5-dimethylindeno[2,1-b]siline.
What is the SMILES notation for 6-bromo-5,5-dimethylindeno[2,1-b]siline?
The canonical SMILES for 6-bromo-5,5-dimethylindeno[2,1-b]siline is CC1(C)C(Br)=CC=C2C=c3[siH]cccc3=C21.
What is the InChIKey of 6-bromo-5,5-dimethylindeno[2,1-b]siline?
The InChIKey is YAOPLLBMGISYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrSi/c1-14(2)12(15)6-5-9-8-11-10(13(9)14)4-3-7-16-11/h3-8,16H,1-2H3.
What are the key properties of 6-bromo-5,5-dimethylindeno[2,1-b]siline?
6-bromo-5,5-dimethylindeno[2,1-b]siline has a molecular weight of 289.25 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5,5-dimethylindeno[2,1-b]siline is sourced from PubChem (CID 175724983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).