Ammonium, (4-hydroxy-o-tolyl)trimethyl-, iodide, methylcarbamate
Basic information
- CAS
64050-12-0- Standard SMILES
CNC(=O)Oc1ccc([N+](C)(C)C)c(C)c1.[I-]- InChIKey
MZYXRHJTHJOTRH-UHFFFAOYSA-N- Molecular formula
- C12H19IN2O2
- Average molar mass
- 350.2 g/mol
- Monoisotopic mass
- 350.04913
Names & identifiers
- Preferred name
- Ammonium, (4-hydroxy-o-tolyl)trimethyl-, iodide, methylcarbamate
- IUPAC
- trimethyl-[2-methyl-4-(methylcarbamoyloxy)phenyl]azanium iodide
Names & synonyms
TL-1446AMMONIUM, (4-HYDROXY-o-TOLYL)TRIMETHYL-, IODIDE, METHYLCARBAMATECarbamic acid, N-methyl-, 3-methyl-4-dimethylaminophenyl ester, methiodide64050-12-0RefChem:318931
Database identifiers
- CAS
64050-12-0- PubChem CID
- 46982
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
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Compound notes
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