Basic information
- CAS
2193-16-0- Standard SMILES
C=CCOc1cc(C(F)(F)F)ccc1C(=O)NCCN(CC)CC.Cl- InChIKey
PYBOYPRLHMLIIJ-UHFFFAOYSA-N- Molecular formula
- C17H24ClF3N2O2
- Average molar mass
- 380.8 g/mol
- Monoisotopic mass
- 380.1478402
Names & identifiers
- Preferred name
- 2-(Allyloxy)-N-(2-(diethylamino)ethyl)-alpha,alpha,alpha-trifluoro-p-toluamide hydrochloride
- IUPAC
- N-[2-(diethylamino)ethyl]-2-prop-2-enoxy-4-(trifluoromethyl)benzamide;hydrochloride
- English name
- 2-(allyloxy)-N-[2-(diethylamino)ethyl]-alpha,alpha,alpha-trifluoro-p-toluamide hydrochloride
- Molecular formula
- C17H24ClF3N2O2
- Molecular weight
- 380.8328696
Names & synonyms
2193-16-0N-(2-diethylaminoethyl)-2-prop-2-enoxy-4-(trifluoromethyl)benzamide hydrochloride2-(Allyloxy)-N-(2-(diethylamino)ethyl)-alpha,alpha,alpha-trifluoro-p-toluamide hydrochloride2-(allyloxy)-N-[2-(diethylamino)ethyl]-alpha,alpha,alpha-trifluoro-p-toluamide hydrochlorideEINECS 218-590-5DTXSID70176342NS00027000N-[2-(Diethylamino)ethyl]-2-[(prop-2-en-1-yl)oxy]-4-(trifluoromethyl)benzamide--hydrogen chloride (1/1)
Database identifiers
- CAS
2193-16-0- PubChem CID
- 3014085
- DTXSID
DTXSID70176342- EC Number
- 218-590-5
Properties
Computed structural properties
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- Melting point
- 108 · 108-109 °C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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