Basic information
- CAS
18659-44-4- Standard SMILES
CNC(=O)Oc1c(C)ccc(C(C)C)c1[N+](C)(C)C.[I-]- InChIKey
PQGARRAFQVRHRR-UHFFFAOYSA-N- Molecular formula
- C15H25IN2O2
- Average molar mass
- 392.28 g/mol
- Monoisotopic mass
- 392.09608
Names & identifiers
- Preferred name
- Ammonium, (6-hydroxythymyl)trimethyl-, iodide, methylcarbamate
- IUPAC
- trimethyl-[3-methyl-2-(methylcarbamoyloxy)-6-propan-2-ylphenyl]azanium iodide
Names & synonyms
Carbamic acid, methyl-, (5-trimethylammonio)carvacryl ester, iodide18659-44-4Ammonium, (6-(N-methylcarbamoyloxy)thymyl)trimethyl-, iodideCarbamic acid, N-methyl-, 4-dimethylaminocarvacryl ester, methiodideAMMONIUM, (6-HYDROXYTHYMYL)TRIMETHYL-, IODIDE, METHYLCARBAMATERefChem:318965SCHEMBL29393246trimethyl-[3-methyl-2-(methylcarbamoyloxy)-6-propan-2-ylphenyl]azanium;iodide
Database identifiers
- CAS
18659-44-4- PubChem CID
- 29191
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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