Basic information
- CAS
172804-54-5- Standard SMILES
CC(C)(Cc1ccccc1)NC(=O)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
AMORFCAPHKNTTL-UHFFFAOYSA-N- Molecular formula
- C14H14F7NO
- Average molar mass
- 345.26 g/mol
- Monoisotopic mass
- 345.0963612
Names & identifiers
- Preferred name
- Phentermine, n-heptafluorobutyryl deriv.
- IUPAC
- 2,2,3,3,4,4,4-heptafluoro-N-(2-methyl-1-phenylpropan-2-yl)butanamide
Names & synonyms
Phentermine, n-heptafluorobutyryl deriv.Phentermine, HFBAMORFCAPHKNTTL-UHFFFAOYSA-NDTXSID401345100172804-54-5N-(1,1-Dimethyl-2-phenylethyl)-2,2,3,3,4,4,4-heptafluorobutanamideN-(1,1-Dimethyl-2-phenylethyl)-2,2,3,3,4,4,4-heptafluorobutanamide #
Database identifiers
- CAS
172804-54-5- PubChem CID
- 620209
- DTXSID
DTXSID401345100
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 425
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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