2-(2-Methoxy-1H-indol-3-yl)-N,N,N-trimethylethan-1-aminium iodide
Basic information
- CAS
6582-72-5- Standard SMILES
COc1[nH]c2ccccc2c1CC[N+](C)(C)C.[I-]- InChIKey
MLPDBGDTYHFFJR-UHFFFAOYSA-M- Molecular formula
- C14H21IN2O
- Average molar mass
- 360.23 g/mol
- Monoisotopic mass
- 360.06986
Names & identifiers
- Preferred name
- 2-(2-Methoxy-1H-indol-3-yl)-N,N,N-trimethylethan-1-aminium iodide
- IUPAC
- 2-(2-methoxy-1H-indol-3-yl)ethyl-trimethylazanium iodide
- English name
- 2-(5-Methoxy-1H-indol-3-yl)-N,N,N-trimethylethanaminium iodide
- Molecular formula
- C14H21N2O.I
- Molecular weight
- 360.23
Names & synonyms
6582-72-5DTXSID609843122-(2-Methoxy-1H-indol-3-yl)-N,N,N-trimethylethan-1-aminium iodideRefChem:1060889DTXCID901411528AMMONIUM, (2-(5-METHOXYINDOL-3-YL)ETHYL)TRIMETHYL-, IODIDE5-Methoxy-N,N-dimethyl-tryptamine methiodide2-(5-Methoxy-1H-indol-3-yl)-N,N,N-trimethylethanaminium iodide1H-Indole-3-ethanaminium, 5-methoxy-N,N,N-trimethyl-, iodide (1:1)
Database identifiers
- CAS
6582-72-5- PubChem CID
- 23058
- DTXSID
DTXSID60984312
Properties
Computed structural properties
- Topological polar surface area
- 25 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Melting point
- 185 · 185-186 °C(Solvent: Ethanol)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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