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Phenol, 4,5-dichloro-2-(2,4,5-trichlorophenoxy)-

HCID 43711
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Basic information

CAS
61639-90-5
Standard SMILES
Oc1cc(Cl)c(Cl)cc1Oc1cc(Cl)c(Cl)cc1Cl
InChIKey
CMCNHNDDWPGEBH-UHFFFAOYSA-N
Molecular formula
C12H5Cl5O2
Average molar mass
358.4 g/mol
Monoisotopic mass
355.873218

Names & identifiers

Preferred name
Phenol, 4,5-dichloro-2-(2,4,5-trichlorophenoxy)-
IUPAC
4,5-dichloro-2-(2,4,5-trichlorophenoxy)phenol

Names & synonyms

4,5-DICHLORO-2-(2,4,5-TRICHLOROPHENOXY)PHENOLPhenol, 4,5-dichloro-2-(2,4,5-trichlorophenoxy)-BRN 247648661639-90-5DTXSID10210653RefChem:369179DTXCID401331442',4,4',5,5'-pentachloro-2-phenoxyphenol

Database identifiers

CAS
61639-90-5
PubChem CID
43711
DTXSID
DTXSID10210653
Nikkaji
J1.621.323C

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
306

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Compound notes

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