Acetamide, N-(3,4-dichlorophenyl)-2,2,2-trifluor
Basic information
- CAS
64694-85-5- Standard SMILES
O=C(Nc1ccc(Cl)c(Cl)c1)C(F)(F)F- InChIKey
CEUUTXSUYHNAJK-UHFFFAOYSA-N- Molecular formula
- C8H4Cl2F3NO
- Average molar mass
- 258.02 g/mol
- Monoisotopic mass
- 256.9622036
Names & identifiers
- Preferred name
- Acetamide, N-(3,4-dichlorophenyl)-2,2,2-trifluor
- IUPAC
- N-(3,4-dichlorophenyl)-2,2,2-trifluoroacetamide
- English name
- N-(3,4-dichlorophenyl)-2,2,2-trifluoroacetamide
- Molecular formula
- C8H4Cl2F3NO
- Molecular weight
- 258.02
Names & synonyms
64694-85-5DTXSID00879273RefChem:315132DTXCID201017286ACETAMIDE, N-(3,4-DICHLOROPHENYL)-2,2,2-TRIFLUORN-(3,4-dichlorophenyl)-2,2,2-trifluoroacetamideMFCD00584859SCHEMBL4403329HTS27883AKOS002262321CS-0190232ST45179769
Show more names
Acetamide, N-(3,4-dichlorophenyl)-2,2,2-trifluoro-
E89482N-(3,4-dichlorophenyl)-2,2,2-trifluoro-acetamide
Database identifiers
- CAS
64694-85-5- PubChem CID
- 706871
- DTXSID
DTXSID00879273- Nikkaji
- J1.607.609K
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 247
Experimental & physicochemical properties
LogP3.9
Physicochemical properties
- Boiling point
- 305 · 305.0±42.0 °C(Predicted)
- Density
- 1.584 · 1.584±0.06 g/cm3(Predicted)
- pka
- 8.51 · 8.51±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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