2',4',6'-Trifluoroacetanilide
Basic information
- CAS
363-40-6- Standard SMILES
CC(=O)Nc1c(F)cc(F)cc1F- InChIKey
UJBJFKXPSUIWEA-UHFFFAOYSA-N- Molecular formula
- C8H6F3NO
- Average molar mass
- 189.13 g/mol
- Monoisotopic mass
- 189.0401483
Names & identifiers
- Preferred name
- 2',4',6'-Trifluoroacetanilide
- IUPAC
- N-(2,4,6-trifluorophenyl)acetamide
- English name
- 2',4',6'-Trifluoroacetanilide
- Molecular formula
- C8H6F3NO
- Molecular weight
- 189.13
Names & synonyms
2',4',6'-TrifluoroacetanilideRefChem:439404692-884-5363-40-6N-(2,4,6-trifluorophenyl)acetamide2,4,6-TrifluoroacetanilideMFCD02093332SCHEMBL2566903DTXSID90380287SBB090898AKOS006228212H82168
Show more names
SKL786-Trifluoroacetanilide2,4,6-TrifluorophenylacetamideAcetamide, N-(2,4,6-trifluorophenyl)-2′,4′,6′-Trifluoroacetanilide, CAS 363-40-6
N-(2,4,6-Trifluorophenyl)acetamide; 2,4,6-Trifluoroacetanilide
Database identifiers
- CAS
363-40-6- PubChem CID
- 2776883
- DTXSID
DTXSID90380287- EC Number
- 692-884-5
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Melting point
- 152 · 152-154
- Boiling point
- 247.8 · 247.8±40.0 °C(Predicted)
- Density
- 1.399 · 1.399±0.06 g/cm3(Predicted)
- pka
- 11.93 · 11.93±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2924297099 · 2924297099
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Suppliers
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Related reactions
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Compound notes
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