2-bromo-5-(2-chlorophenyl)phenol

C12H8BrClO — CID 171383319

IUPAC2-bromo-5-(2-chlorophenyl)phenol
SMILESOc1cc(-c2ccccc2Cl)ccc1Br
InChIInChI=1S/C12H8BrClO/c13-10-6-5-8(7-12(10)15)9-3-1-2-4-11(9)14/h1-7,15H
InChIKeyKSTYLTZXEHNDJI-UHFFFAOYSA-N
MW283.55 g/mol
LogP4.48
Rot. Bonds1

About 2-bromo-5-(2-chlorophenyl)phenol

2-bromo-5-(2-chlorophenyl)phenol (PubChem CID 171383319) has the molecular formula C12H8BrClO and a molecular weight of 283.55 g/mol. Its IUPAC name is 2-bromo-5-(2-chlorophenyl)phenol.

Molecular Properties

Compound Name2-bromo-5-(2-chlorophenyl)phenol
PubChem CID171383319
Molecular FormulaC12H8BrClO
Molecular Weight283.55 g/mol
Exact Mass281.94
IUPAC Name2-bromo-5-(2-chlorophenyl)phenol
SMILESOc1cc(-c2ccccc2Cl)ccc1Br
InChIInChI=1S/C12H8BrClO/c13-10-6-5-8(7-12(10)15)9-3-1-2-4-11(9)14/h1-7,15H
InChIKeyKSTYLTZXEHNDJI-UHFFFAOYSA-N
XLogP4.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.55
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-chlorophenyl)phenol?
The IUPAC name of 2-bromo-5-(2-chlorophenyl)phenol (CID 171383319) is 2-bromo-5-(2-chlorophenyl)phenol.
What is the SMILES notation for 2-bromo-5-(2-chlorophenyl)phenol?
The canonical SMILES for 2-bromo-5-(2-chlorophenyl)phenol is Oc1cc(-c2ccccc2Cl)ccc1Br.
What is the InChIKey of 2-bromo-5-(2-chlorophenyl)phenol?
The InChIKey is KSTYLTZXEHNDJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrClO/c13-10-6-5-8(7-12(10)15)9-3-1-2-4-11(9)14/h1-7,15H.
What are the key properties of 2-bromo-5-(2-chlorophenyl)phenol?
2-bromo-5-(2-chlorophenyl)phenol has a molecular weight of 283.55 g/mol, XLogP of 4.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-chlorophenyl)phenol is sourced from PubChem (CID 171383319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).