2-bromo-5-chlorophenol

C6H4BrClO — CID 13284272

IUPAC2-bromo-5-chlorophenol
SMILESOc1cc(Cl)ccc1Br
InChIInChI=1S/C6H4BrClO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H
InChIKeyFMRKYXVZQWHGDA-UHFFFAOYSA-N
MW207.45 g/mol
LogP2.81
Rot. Bonds

About 2-bromo-5-chlorophenol

2-bromo-5-chlorophenol (PubChem CID 13284272) has the molecular formula C6H4BrClO and a molecular weight of 207.45 g/mol. Its IUPAC name is 2-bromo-5-chlorophenol.

Molecular Properties

Compound Name2-bromo-5-chlorophenol
PubChem CID13284272
Molecular FormulaC6H4BrClO
Molecular Weight207.45 g/mol
Exact Mass205.91
IUPAC Name2-bromo-5-chlorophenol
SMILESOc1cc(Cl)ccc1Br
InChIInChI=1S/C6H4BrClO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H
InChIKeyFMRKYXVZQWHGDA-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.45
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-chlorophenol?
The IUPAC name of 2-bromo-5-chlorophenol (CID 13284272) is 2-bromo-5-chlorophenol.
What is the SMILES notation for 2-bromo-5-chlorophenol?
The canonical SMILES for 2-bromo-5-chlorophenol is Oc1cc(Cl)ccc1Br.
What is the InChIKey of 2-bromo-5-chlorophenol?
The InChIKey is FMRKYXVZQWHGDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H.
What are the key properties of 2-bromo-5-chlorophenol?
2-bromo-5-chlorophenol has a molecular weight of 207.45 g/mol, XLogP of 2.81, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-chlorophenol is sourced from PubChem (CID 13284272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).