CID 88827800

C6H7BiBr2 — CID 88827800

IUPAC—
SMILESBr.Br.[Bi]c1ccccc1
InChIInChI=1S/C6H5.Bi.2BrH/c1-2-4-6-5-3-1;;;/h1-5H;;2*1H
InChIKeyTWXQYXDVHHPUQP-UHFFFAOYSA-N
MW447.91 g/mol
LogP1.64
Rot. Bonds

About CID 88827800

CID 88827800 (PubChem CID 88827800) has the molecular formula C6H7BiBr2 and a molecular weight of 447.91 g/mol.

Molecular Properties

Compound NameCID 88827800
PubChem CID88827800
Molecular FormulaC6H7BiBr2
Molecular Weight447.91 g/mol
Exact Mass445.87
IUPAC Name—
SMILESBr.Br.[Bi]c1ccccc1
InChIInChI=1S/C6H5.Bi.2BrH/c1-2-4-6-5-3-1;;;/h1-5H;;2*1H
InChIKeyTWXQYXDVHHPUQP-UHFFFAOYSA-N
XLogP1.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.91
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze CID 88827800 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 88827800?
The IUPAC name of CID 88827800 (CID 88827800) is not available.
What is the SMILES notation for CID 88827800?
The canonical SMILES for CID 88827800 is Br.Br.[Bi]c1ccccc1.
What is the InChIKey of CID 88827800?
The InChIKey is TWXQYXDVHHPUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5.Bi.2BrH/c1-2-4-6-5-3-1;;;/h1-5H;;2*1H.
What are the key properties of CID 88827800?
CID 88827800 has a molecular weight of 447.91 g/mol, XLogP of 1.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88827800 is sourced from PubChem (CID 88827800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).