N,N,N-trimethyl-1-(perfluorophenyl)methanaminium | SBID = 2062 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 1.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 0.0 | ||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | C10H11F5N+ | ||
| M / g/mol: | 240.193056 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: typical guest, charged
- Name: N,N,N-trimethyl-1-(perfluorophenyl)methanaminium
- Preferred Abbreviation: 5FBTMA
- IUPAC Name:
- CAS:
- CID: -889
- InChiKey: IBWRLATWYQIMSE-UHFFFAOYSA-N
- InChi: InChI=1S/C10H11F5N/c1-16(2,3)4-5-6(11)8(13)10(15)9(14)7(5)12/h4H2,1-3H3/q+1
- CanoSmiles: Fc1c(C[N+](C)(C)C)c(F)c(c(c1F)F)F
- IsoSmiles: FC1=C(F)C(F)=C(F)C(F)=C1C[N+](C)(C)C
