2,4-Dibromo-6-(2,4-Dibromophenoxy)Phenol

HCID 4563

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Basic information

CAS: 80246-25-9
Standard SMILES: Oc1c(Br)cc(Br)cc1Oc1ccc(Br)cc1Br
InChIKey: QEPYTQFGTBSZQY-UHFFFAOYSA-N
Molecular formula: C12H6Br4O2
Average molar mass: 501.79 g/mol
Monoisotopic mass: 497.71013

Overview

2,4-Dibromo-6-(2,4-dibromophenoxy)phenol has been reported in Lendenfeldia plicata, Lamellodysidea herbacea, and Dysidea with data available.

Names & identifiers

Preferred name: 2,4-Dibromo-6-(2,4-Dibromophenoxy)Phenol
IUPAC: 2,4-dibromo-6-(2,4-dibromophenoxy)phenol

Names & synonyms

2,4-dibromo-6-(2,4-dibromophenoxy)phenol80246-25-9DTXSID509039912OH-BDE682'-OH-BDE68RefChem:82294DTXCID509005612'-Hydroxy-2,3',4,5'-tetrabromodiphenyletherMLS000563511SMR000232324cid_4563CHEMBL254576

Show more names

SCHEMBL30298313SCHEMBL30298315SCHEMBL30298317BDBM57619NSC714359NSC-7143592'-hydroxy-2,3',4,5'-tetrabromodiphenyl ether2-[2,4-bis(bromanyl)phenoxy]-4,6-bis(bromanyl)phenol

Database identifiers

CAS: 80246-25-9
PubChem CID: 4563
DTXSID: DTXSID50903991
ChEMBL: CHEMBL254576
Nikkaji: J872.896H

Properties

Computed structural properties

XLogP: 5.9
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 279

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Compound notes

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