Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:38852 - 4-bromo-2-chlorophenol
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
4-bromo-2-chlorophenol
ChEBI ID
CHEBI:38852
Definition
A halophenol that is phenol in which the hydrogens at positions 2 and 4 have been replaced by chlorine and bromine, respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C6H4BrClO
Net Charge
0
Average Mass
207.45206
Monoisotopic Mass
205.91341
InChI
InChI=1S/C6H4BrClO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChIKey
VIBJPUXLAKVICD-UHFFFAOYSA-N
SMILES
Oc1ccc(Br)cc1Cl
ChEBI Ontology
Outgoing
4-bromo-2-chlorophenol (
CHEBI:38852
)
is a
halophenol (
CHEBI:38856
)
4-bromo-2-chlorophenol (
CHEBI:38852
)
is a
monochlorobenzenes (
CHEBI:83403
)
4-bromo-2-chlorophenol (
CHEBI:38852
)
is a
organobromine compound (
CHEBI:37141
)
Incoming
profenofos (
CHEBI:38845
)
has functional parent
4-bromo-2-chlorophenol (
CHEBI:38852
)
IUPAC Name
4-bromo-2-chlorophenol
Synonym
Source
2-Chloro-4-bromophenol
NIST Chemistry WebBook
Registry Numbers
Types
Sources
2042867
Beilstein Registry Number
Beilstein
3964-56-5
CAS Registry Number
NIST Chemistry WebBook
3964-56-5
CAS Registry Number
ChemIDplus
Last Modified
23 October 2014