Basic information
- CAS
64051-11-2- Standard SMILES
C[N+](C)(C)c1cccc(OC(=O)N2CCCCC2)c1.[I-]- InChIKey
UHSXLNORVAZTLD-UHFFFAOYSA-M- Molecular formula
- C15H23IN2O2
- Average molar mass
- 390.26 g/mol
- Monoisotopic mass
- 390.08043
Names & identifiers
- Preferred name
- Ammonium, (m-hydroxyphenyl)trimethyl-, iodide, 1-piperidinecarboxylate
- IUPAC
- trimethyl-[3-(piperidine-1-carbonyloxy)phenyl]azanium iodide
Names & synonyms
TL-13081-Piperidinecarboxylic acid, m-(trimethylammonio)phenyl ester, iodide64051-11-2Ammonium, (3-(pentamethylenecarbamoyloxy)phenyl)trimethyl-, iodideCarbamic acid, pentamethylene-, m-(trimethylammonio)phenyl ester, iodideAMMONIUM, (m-HYDROXYPHENYL)TRIMETHYL-, IODIDE, 1-PIPERIDINECARBOXYLATECarbamic acid, N,N-pentamethylene-, 3-dimethylaminophenyl ester, methiodideRefChem:319007DTXSID90982442N,N,N-Trimethyl-3-[(piperidine-1-carbonyl)oxy]anilinium iodide
Database identifiers
- CAS
64051-11-2- PubChem CID
- 47065
- DTXSID
DTXSID90982442
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 306
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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