2-bromo-6-chloro-4-phenoxyphenol

C12H8BrClO2 — CID 164893883

IUPAC2-bromo-6-chloro-4-phenoxyphenol
SMILESOc1c(Cl)cc(Oc2ccccc2)cc1Br
InChIInChI=1S/C12H8BrClO2/c13-10-6-9(7-11(14)12(10)15)16-8-4-2-1-3-5-8/h1-7,15H
InChIKeyJEYVPWRTIZRWHK-UHFFFAOYSA-N
MW299.55 g/mol
LogP4.60
Rot. Bonds2

About 2-bromo-6-chloro-4-phenoxyphenol

2-bromo-6-chloro-4-phenoxyphenol (PubChem CID 164893883) has the molecular formula C12H8BrClO2 and a molecular weight of 299.55 g/mol. Its IUPAC name is 2-bromo-6-chloro-4-phenoxyphenol.

Molecular Properties

Compound Name2-bromo-6-chloro-4-phenoxyphenol
PubChem CID164893883
Molecular FormulaC12H8BrClO2
Molecular Weight299.55 g/mol
Exact Mass297.94
IUPAC Name2-bromo-6-chloro-4-phenoxyphenol
SMILESOc1c(Cl)cc(Oc2ccccc2)cc1Br
InChIInChI=1S/C12H8BrClO2/c13-10-6-9(7-11(14)12(10)15)16-8-4-2-1-3-5-8/h1-7,15H
InChIKeyJEYVPWRTIZRWHK-UHFFFAOYSA-N
XLogP4.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.55
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-bromo-3-chloro-2-methoxy-5-phenoxybenzene
CID 171366803
2,6-dichloro-4-(4-chlorophenoxy)phenol
CID 21278927
5-phenoxybenzene-1,2,3-triol
CID 14020516
1,3,5-tris[4-(4-phenoxyphenoxy)phenoxy]benzene
CID 167430627
2-bromo-1-fluoro-4-phenoxybenzene
CID 71774083
5-bromo-3-phenoxybenzene-1,2-diol
CID 122706591
chlorobenzene;phenoxybenzene
CID 66911253
2,6-dibromo-3-phenoxyphenol
CID 102457047
CID 159259752
CID 159259752
iron;phenoxybenzene
CID 174434720
potassium phenoxybenzene
CID 19858586
N-(3-bromo-4-phenoxyphenyl)-3,5-dichloro-2-hydroxybenzamide
CID 162656930

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-chloro-4-phenoxyphenol?
The IUPAC name of 2-bromo-6-chloro-4-phenoxyphenol (CID 164893883) is 2-bromo-6-chloro-4-phenoxyphenol.
What is the SMILES notation for 2-bromo-6-chloro-4-phenoxyphenol?
The canonical SMILES for 2-bromo-6-chloro-4-phenoxyphenol is Oc1c(Cl)cc(Oc2ccccc2)cc1Br.
What is the InChIKey of 2-bromo-6-chloro-4-phenoxyphenol?
The InChIKey is JEYVPWRTIZRWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrClO2/c13-10-6-9(7-11(14)12(10)15)16-8-4-2-1-3-5-8/h1-7,15H.
What are the key properties of 2-bromo-6-chloro-4-phenoxyphenol?
2-bromo-6-chloro-4-phenoxyphenol has a molecular weight of 299.55 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-chloro-4-phenoxyphenol is sourced from PubChem (CID 164893883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).