2',3',4'-Trichloroacetanilide
Basic information
- CAS
99310-47-1- Standard SMILES
CC(=O)Nc1ccc(Cl)c(Cl)c1Cl- InChIKey
LOQQPVJIFHAQCW-UHFFFAOYSA-N- Molecular formula
- C8H6Cl3NO
- Average molar mass
- 238.5 g/mol
- Monoisotopic mass
- 236.951497
Names & identifiers
- Preferred name
- 2',3',4'-Trichloroacetanilide
- IUPAC
- N-(2,3,4-trichlorophenyl)acetamide
Names & synonyms
2',3',4'-TRICHLOROACETANILIDERefChem:439348653-982-3N-(2,3,4-trichlorophenyl)acetamideAcetamide, N-(2,3,4-trichlorophenyl)-99310-47-12,3,4-trichloroacetanilideSCHEMBL6461998DTXSID20403534AKOS024323781
Database identifiers
- CAS
99310-47-1- PubChem CID
- 4461900
- DTXSID
DTXSID20403534- EC Number
- 653-982-3
- Nikkaji
- J1.598.151B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Experimental & physicochemical properties
LogP2.88
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, 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 CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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