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2-(2,3,5,6-Tetrachlorophenyl)-3,4,5-trichlorothiophene

HCID 5201342
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
6673-86-5
Standard SMILES
Clc1cc(Cl)c(Cl)c(-c2sc(Cl)c(Cl)c2Cl)c1Cl
InChIKey
KDSDCDNFHRZMDM-UHFFFAOYSA-N
Molecular formula
C10HCl7S
Average molar mass
401.3 g/mol
Monoisotopic mass
397.761865

Names & identifiers

Preferred name
2-(2,3,5,6-Tetrachlorophenyl)-3,4,5-trichlorothiophene
IUPAC
2,3,4-trichloro-5-(2,3,5,6-tetrachlorophenyl)thiophene

Names & synonyms

2-(2,3,5,6-TETRACHLOROPHENYL)-3,4,5-TRICHLOROTHIOPHENERefChem:45172871906-18-8660-432-66673-86-52,3,4-trichloro-5-(2,3,5,6-tetrachlorophenyl)thiopheneDTXSID20409536AKOS024433392

Database identifiers

CAS
6673-86-5、71906-18-8
PubChem CID
5201342
DTXSID
DTXSID20409536
EC Number
660-432-6

Properties

Computed structural properties

XLogP
8
Topological polar surface area
28.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
18
Formal charge
0
Complexity
290

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

Related reactions

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Compound notes

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