Ammonium, ((2-hydroxy-5-isopropyl)phenyl)trimethyl-, iodide, dimethylcarbamate
Basic information
- CAS
64046-25-9- Standard SMILES
CC(C)c1ccc(OC(=O)N(C)C)c([N+](C)(C)C)c1.[I-]- InChIKey
UYIQQMNVTFFUHZ-UHFFFAOYSA-M- Molecular formula
- C15H25IN2O2
- Average molar mass
- 392.28 g/mol
- Monoisotopic mass
- 392.09608
Names & identifiers
- Preferred name
- Ammonium, ((2-hydroxy-5-isopropyl)phenyl)trimethyl-, iodide, dimethylcarbamate
- IUPAC
- [2-(dimethylcarbamoyloxy)-5-propan-2-ylphenyl]-trimethylazanium iodide
Names & synonyms
SB-1864046-25-9Carbamic acid, dimethyl-, (4-isopropyl-2-(trimethylammonio)phenyl) ester, iodideAmmonium, (2-(dimethylcarbamoyloxy)-5-isopropylphenyl)trimethyl-, iodideCarbamic acid, N,N-dimethyl-, 2-dimethylamino-4-isopropylphenyl ester, methiodideAMMONIUM, ((2-HYDROXY-5-ISOPROPYL)PHENYL)TRIMETHYL-, IODIDE, DIMETHYLCARBAMATERefChem:318621SCHEMBL29394067DTXSID109821662-[(Dimethylcarbamoyl)oxy]-N,N,N-trimethyl-5-(propan-2-yl)anilinium iodide
Database identifiers
- CAS
64046-25-9- PubChem CID
- 46596
- DTXSID
DTXSID10982166
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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