Basic information
- CAS
156572-21-3- Standard SMILES
CC(Cc1ccc2c(c1)OCO2)N(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
ZGHICVNRTPSTFX-UHFFFAOYSA-N- Molecular formula
- C15H14F7NO3
- Average molar mass
- 389.26 g/mol
- Monoisotopic mass
- 389.08619044
Names & identifiers
- Preferred name
- N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-2,2,3,3,4,4,4-heptafluoro-N-methylbutanamide
- IUPAC
- N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-2,2,3,3,4,4,4-heptafluoro-N-methylbutanamide
Names & synonyms
N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-2,2,3,3,4,4,4-heptafluoro-N-methylbutanamideZGHICVNRTPSTFX-UHFFFAOYSA-NDTXSID601345001156572-21-33,4-Methylenedioxymethamphetamine-heptafluoroacylN-[2-(1,3-Benzodioxol-5-yl)-1-methylethyl]-2,2,3,3,4,4,4-heptafluoro-N-methylbutanamide
Database identifiers
- CAS
156572-21-3- PubChem CID
- 620258
- DTXSID
DTXSID601345001
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 526
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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