Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate
Basic information
- CAS
63981-70-4- Standard SMILES
CCc1ccc([N+](C)(C)C)c(OC(=O)NC)c1.[I-]- InChIKey
ITGQHNORHQPLEC-UHFFFAOYSA-N- Molecular formula
- C13H21IN2O2
- Average molar mass
- 364.22 g/mol
- Monoisotopic mass
- 364.06478
Names & identifiers
- Preferred name
- Ammonium, ((3-hydroxy-4-ethyl)phenyl)trimethyl-, iodide, methylcarbamate
- IUPAC
- [4-ethyl-2-(methylcarbamoyloxy)phenyl]-trimethylazanium iodide
Names & synonyms
Carbamic acid, methyl-, (2-ethyl-5-(trimethylammonio)phenyl) ester, iodideT-172263981-70-4Ammonium, ((4-ethyl-3-methylcarbamoyloxy)phenyl)trimethyl-, iodideCarbamic acid, N-methyl-, 3-dimethylamino-6-ethylphenyl ester, methiodideAMMONIUM, ((3-HYDROXY-4-ETHYL)PHENYL)TRIMETHYL-, IODIDE, METHYLCARBAMATERefChem:318637
Database identifiers
- CAS
63981-70-4- PubChem CID
- 45991
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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