CID 20625474

C6H4BrSi — CID 20625474

IUPAC—
SMILES[Si]c1ccc(Br)cc1
InChIInChI=1S/C6H4BrSi/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKeyWTXBPCOONPZDSU-UHFFFAOYSA-N
MW184.09 g/mol
LogP1.24
Rot. Bonds

About CID 20625474

CID 20625474 (PubChem CID 20625474) has the molecular formula C6H4BrSi and a molecular weight of 184.09 g/mol.

Molecular Properties

Compound NameCID 20625474
PubChem CID20625474
Molecular FormulaC6H4BrSi
Molecular Weight184.09 g/mol
Exact Mass182.93
IUPAC Name—
SMILES[Si]c1ccc(Br)cc1
InChIInChI=1S/C6H4BrSi/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKeyWTXBPCOONPZDSU-UHFFFAOYSA-N
XLogP1.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.09
LogP ≤ 51.24
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 CID 20625474?
The IUPAC name of CID 20625474 (CID 20625474) is not available.
What is the SMILES notation for CID 20625474?
The canonical SMILES for CID 20625474 is [Si]c1ccc(Br)cc1.
What is the InChIKey of CID 20625474?
The InChIKey is WTXBPCOONPZDSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrSi/c7-5-1-3-6(8)4-2-5/h1-4H.
What are the key properties of CID 20625474?
CID 20625474 has a molecular weight of 184.09 g/mol, XLogP of 1.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20625474 is sourced from PubChem (CID 20625474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).