2,2,2-Trifluoro-N-(trifluoroacetyl)acetamide
Basic information
- CAS
407-24-9- Standard SMILES
O=C(NC(=O)C(F)(F)F)C(F)(F)F- InChIKey
GMQVFHZSXKJCIV-UHFFFAOYSA-N- Molecular formula
- C4HF6NO2
- Average molar mass
- 209.05 g/mol
- Monoisotopic mass
- 208.99114759
Names & identifiers
- Preferred name
- 2,2,2-Trifluoro-N-(trifluoroacetyl)acetamide
- IUPAC
- 2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
- English name
- Bistrifluoroacetamide
- Molecular formula
- C4HF6NO2
- Molecular weight
- 209.05
Names & synonyms
2,2,2-Trifluoro-N-(trifluoroacetyl)acetamideEINECS 206-981-3RefChem:440506206-981-3Bistrifluoroacetamide407-24-92,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamidePerfluorodiacetamideMFCD00013564BTFAC4HF6NO2bis(trifluoroacetamide)
Show more names
Bistrifluoroacetamide >N-(phenylmethyl)formamideBis(trifluoroacetyl)amineDiacetamide, 2,2,2,2',2',2'-hexafluoro-Acetamide, 2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)-
SCHEMBL2053132SCHEMBL9733225DTXSID10193674WSYYGNDAYUUUJV-UHFFFAOYSA-NAKOS015910050FS-4559SY050379DB-049640
Database identifiers
- CAS
407-24-9- PubChem CID
- 67885
- DTXSID
DTXSID10193674- EC Number
- 206-981-3
- Nikkaji
- J101.817E
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- Melting point
- 80 · 80-86 °C
- Boiling point
- 120 °C · 120 °C / 1mmHg
- Density
- 1.603 · 1.603±0.06 g/cm3(Predicted)
- solubility
- almost transparency in hot Toluene
- form
- powder to crystal
- pka
- 3.04 · 3.04±0.46(Predicted)
- color
- White to Almost white
- BRN
- 1793118 · 1793118
- InChI
- 1S/C4HF6NO2/c5-3(6,7)1(12)11-2(13)4(8,9)10/h(H,11,12,13)
- InChIKey
- GMQVFHZSXKJCIV-UHFFFAOYSA-N
- SMILES
- FC(F)(F)C(=O)NC(=O)C(F)(F)F
- CAS DataBase Reference
- 407 · 407-24-9(CAS DataBase Reference)
- EPA Substance Registry System
- Perfluorodiacetamide (407-24-9)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Hazard Codes
- C
- Risk Statements
- 36 · 36/37/38-36/38
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 3261 · UN 3261 8/PG 2
- WGK Germany
- 3 · 3
- F
- 3 · 3-10-21
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 29251900 · 29251900
- Storage Class
- 11 · 11 - Combustible Solids
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
Danger
H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P332+P317, P337+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (50%)
Safety data
- F
- 3-10-21
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- ridadr
- UN 3261 8/PG 2
- hs_code
- 29251900
- risk_code
- 36/37/38-36/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- C
- safety_code
- 26-36/37/39
- hazard_class
- 8
- Storage Class
- 11 - Combustible Solids
- packing_group
- III
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…