3',4',5-Trichlorosalicylanilide
Basic information
- CAS
642-84-2- Standard SMILES
O=C(Nc1ccc(Cl)c(Cl)c1)c1cc(Cl)ccc1O- InChIKey
RSJBLPJKXGNMFW-UHFFFAOYSA-N- Molecular formula
- C13H8Cl3NO2
- Average molar mass
- 316.6 g/mol
- Monoisotopic mass
- 314.962062
Names & identifiers
- Preferred name
- 3',4',5-Trichlorosalicylanilide
- IUPAC
- 5-chloro-N-(3,4-dichlorophenyl)-2-hydroxybenzamide
- English name
- 3',4',5-Trichlorosalicylanilide
- Molecular formula
- C13H8Cl3NO2
- Molecular weight
- 316.57
Names & synonyms
3',4',5-Trichlorosalicylanilide642-84-2Anobial2ZOT9K834QNSC-526293RefChem:1065383211-391-45-Chloro-N-(3,4-dichlorophenyl)-2-hydroxybenzamideChlorosalnideMFCD00059622Benzamide, 5-chloro-N-(3,4-dichlorophenyl)-2-hydroxy-CHEMBL100633
Show more names
3,4,5-TRICHLOROSALICYLANILIDE 98+%3',4',5-Trichlorosalicylanilide >3′,4′,5-Trichlorosalicylanilide, CAS 642-84-2
5-chloro-N-(3,4-dichlorophenyl)-2-hydroxy-benzamideSalicylanilide, chloro-UNII-2ZOT9K834Q3,4,5-TrichlorosalicylanilideEINECS 211-391-4NSC 5262933',5-TrichlorosalicylanilideSCHEMBL467396
Database identifiers
- CAS
642-84-2- PubChem CID
- 69506
- DTXSID
DTXSID40214407- ChEMBL
CHEMBL100633- UNII
- 2ZOT9K834Q
- EC Number
- 211-391-4
- Nikkaji
- J7.061K
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Physicochemical properties
- Melting point
- 247 °C · 247°C
- Boiling point
- 388.3 · 388.3±42.0 °C(Predicted)
- Density
- 1.5338 · 1.5338 (rough estimate)
- refractive index
- 1.649 · 1.6490 (estimate)
- pka
- 7.58 · 7.58±0.43(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- FDA UNII
- 2 ZOT9K834Q · 2ZOT9K834Q
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- HS Code
- 2924.29 · 2924.29.7790
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2924.29.7790
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Applications
Uses3',4',5-Trichlorosalicylanilide is more effective as a microbicide than 5,4'-Dibromosalicylanilide, but its use as a microbicide is declining.
Upstream & downstream products
Upstream raw materials
Related reactions
2 records
Compound notes
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