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(R)-1-(2-naphthyl)ethylammonium | SBID = 934 | Compound |
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | 27.6 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.8 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 1.0 | ||
| Number of H-Bond Donors: | 1.0 | ||
| Number of H-Bond Acceptors: | 0.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 145.7 | ||
| Sum Formula: | C12H14N+ | ||
| M / g/mol: | 172.25 | ||
| Complexity: | 167.0 | ||
| Number of Conformers: | 6.0 |
Identifiers
- Tags: aromatic, cation, typical guest, charged
- Name: (R)-1-(2-naphthyl)ethylammonium
- Preferred Abbreviation: (R)-1-(2-naphthyl)ethylammonium
- IUPAC Name: [(1R)-1-naphthalen-2-ylethyl]azanium
- CAS:
- CID: 1798834
- InChiKey: KHSYYLCXQKCYQX-SECBINFHSA-O
- InChi: InChI=1S/C12H13N/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-9H,13H2,1H3/p+1/t9-/m1/s1
- CanoSmiles: CC(C1=CC2=CC=CC=C2C=C1)[NH3+]
- IsoSmiles: C[C@H](C1=CC2=CC=CC=C2C=C1)[NH3+]
