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Ammonium, (3-hydroxy-p-tolyl)trimethyl-, iodide, N-methoxy-N-methylcarbamate

HCID 46978
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Basic information

CAS
64050-10-8
Standard SMILES
CON(C)C(=O)Oc1cc([N+](C)(C)C)ccc1C.[I-]
InChIKey
IWUVVRHOCPCCFE-UHFFFAOYSA-M
Molecular formula
C13H21IN2O3
Average molar mass
380.22 g/mol
Monoisotopic mass
380.05969

Names & identifiers

Preferred name
Ammonium, (3-hydroxy-p-tolyl)trimethyl-, iodide, N-methoxy-N-methylcarbamate
IUPAC
[3-[methoxy(methyl)carbamoyl]oxy-4-methylphenyl]-trimethylazanium iodide

Names & synonyms

TL-1487AMMONIUM, (3-HYDROXY-p-TOLYL)TRIMETHYL-, IODIDE, N-METHOXY-N-METHYLCARBAMATECarbamic acid, N-methoxy-N-methyl-, (2-methyl-5-trimethylammonio)phenyl ester, iodide64050-10-8Ammonium, (3-(N-methoxy-N-methyl)carbamoyloxy-p-tolyl)trimethyl-, iodideCarbamic acid, N-methyl-N-methoxy-, 2-methyl-5-dimethylaminophenyl ester, methiodideRefChem:318875DTXSID509823823-{[Methoxy(methyl)carbamoyl]oxy}-N,N,N,4-tetramethylanilinium iodide

Database identifiers

CAS
64050-10-8
PubChem CID
46978
DTXSID
DTXSID50982382

Properties

Computed structural properties

Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
288

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