Basic information
- CAS
80246-27-1- Standard SMILES
Oc1c(Br)cc(Br)cc1Oc1c(O)c(Br)c(Br)c(Br)c1Br- InChIKey
OMYZFHYKAPRFFQ-UHFFFAOYSA-N- Molecular formula
- C12H4Br6O3
- Average molar mass
- 675.6 g/mol
- Monoisotopic mass
- 669.52607
Overview
2,3,4,5-Tetrabromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol has been reported in Lendenfeldia plicata, Lamellodysidea herbacea, and Dysidea with data available.
Names & identifiers
- Preferred name
- 2,3,4,5-Tetrabromo-6-(3,5-Dibromo-2-Hydroxyphenoxy)Phenol
- IUPAC
- 2,3,4,5-tetrabromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol
Names & synonyms
2,3,4,5-tetrabromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol80246-27-1NSC 364753RefChem:81233CHEMBL150098NSC364753SCHEMBL14385341DTXSID00320811BDBM50135851NSC-3647532,3,4,5-Tetrabromo-6-(3,5-dibromo-2-hydroxy-phenoxy)-phenolBROMOPHENOL,4,5,6-TETRA-,2-(3,5-DIBROMO-2-HYDROXY-PHENOXY
Database identifiers
- CAS
80246-27-1- PubChem CID
- 339231
- DTXSID
DTXSID00320811- ChEMBL
CHEMBL150098- EC Number
- 617-030-0
- Nikkaji
- J692.275I
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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