2,6-dibromophenol

C6H4Br2O — CID 11847

IUPAC2,6-dibromophenol
SMILESOc1c(Br)cccc1Br
InChIInChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKeySSIZLKDLDKIHEV-UHFFFAOYSA-N
MW251.91 g/mol
LogP2.92
Rot. Bonds

About 2,6-dibromophenol

2,6-dibromophenol (PubChem CID 11847) has the molecular formula C6H4Br2O and a molecular weight of 251.91 g/mol. Its IUPAC name is 2,6-dibromophenol.

Molecular Properties

Compound Name2,6-dibromophenol
PubChem CID11847
Molecular FormulaC6H4Br2O
Molecular Weight251.91 g/mol
Exact Mass249.86
IUPAC Name2,6-dibromophenol
SMILESOc1c(Br)cccc1Br
InChIInChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKeySSIZLKDLDKIHEV-UHFFFAOYSA-N
XLogP2.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.91
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,6-dibromophenol with MolForge

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

Launch Full Analysis

Related Compounds

2,4,6-Tribromophenol
CID 1483
2,4-Dibromophenol
CID 12005
2-Bromophenol
CID 7244
4-Bromophenol
CID 7808
3-Bromophenol
CID 11563
2-Bromo-1,4-benzenediol
CID 68502
p-Cresol, 2,6-dibromo-
CID 17078
2,3,4,6-Tetrabromophenol
CID 26665
Xeroform
CID 57347797
2,4,6-Tribromoresorcinol
CID 17094
3,5-Dibromophenol
CID 12280
2,6-Dibromo-4-fluorophenol
CID 67654

Frequently Asked Questions

What is the IUPAC name of 2,6-dibromophenol?
The IUPAC name of 2,6-dibromophenol (CID 11847) is 2,6-dibromophenol.
What is the SMILES notation for 2,6-dibromophenol?
The canonical SMILES for 2,6-dibromophenol is Oc1c(Br)cccc1Br.
What is the InChIKey of 2,6-dibromophenol?
The InChIKey is SSIZLKDLDKIHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H.
What are the key properties of 2,6-dibromophenol?
2,6-dibromophenol has a molecular weight of 251.91 g/mol, XLogP of 2.92, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromophenol is sourced from PubChem (CID 11847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).