Basic information
- CAS
64050-14-2- Standard SMILES
CC[N+](C)(C)c1cc(C)c(OC(=O)NC)cc1C.[I-]- InChIKey
UTOKQAVGLQBAIB-UHFFFAOYSA-N- Molecular formula
- C14H23IN2O2
- Average molar mass
- 378.25 g/mol
- Monoisotopic mass
- 378.08043
Names & identifiers
- Preferred name
- Ammonium, (4-hydroxy-2,5-xylyl)dimethylethyl-, iodide, methylcarbamate
- IUPAC
- [2,5-dimethyl-4-(methylcarbamoyloxy)phenyl]-ethyl-dimethylazanium iodide
Names & synonyms
TL-1489Ammonium, (4-methylcarbamoyloxy-2,5-xylyl)dimethylethyl-, iodideCarbamic acid, methyl-, (4-dimethylethylammonio)-3,5-xylyl ester, iodide64050-14-2AMMONIUM, (4-HYDROXY-2,5-XYLYL)DIMETHYLETHYL-, IODIDE, METHYLCARBAMATECarbamic acid, N-methyl-, 2,5-dimethyl-4-dimethylaminophenyl ester, ethiodideRefChem:318914
Database identifiers
- CAS
64050-14-2- PubChem CID
- 46986
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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