(5-(Ethyl(dimethyl)azaniumyl)-2-methylphenoxy)(methylimino)methanolate--hydrogen iodide (1/1)
Basic information
- CAS
5464-66-4- Standard SMILES
CC[N+](C)(C)c1ccc(C)c(OC(=O)NC)c1.[I-]- InChIKey
ZXUUUMMYLLSGIX-UHFFFAOYSA-N- Molecular formula
- C13H21IN2O2
- Average molar mass
- 364.22 g/mol
- Monoisotopic mass
- 364.06478
Names & identifiers
- Preferred name
- (5-(Ethyl(dimethyl)azaniumyl)-2-methylphenoxy)(methylimino)methanolate--hydrogen iodide (1/1)
- IUPAC
- ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium iodide
Names & synonyms
DTXSID70969918(5-(Ethyl(dimethyl)azaniumyl)-2-methylphenoxy)(methylimino)methanolate--hydrogen iodide (1/1)RefChem:1050557DTXCID201397462TL-13405464-66-4Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)dimethylethyl-, iodideNSC-15409Benzenaminium, N-ethyl-N,N,4-trimethyl-3-(((methylamino)carbonyl)oxy)-, iodideBenzenaminium, N-ethyl-N,N,4-trimethyl-3-[[(methylamino)carbonyl]oxy]-, iodideNSC 15409LLT5NGX84G
Show more names
AMMONIUM, (3-HYDROXY-p-TOLYL)DIMETHYLETHYL-, IODIDE, METHYLCARBAMATECarbamic acid, methyl-, (5-(dimethylethylammonio)-o-tolyl) ester, iodideCarbamic acid, N-methyl-, 2-methyl-5-dimethylaminophenyl ester, ethiodideNSC15409ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium iodideWLN: 2K1&1&R D1 COVM1 &Q &IBenzenaminium,N,4-trimethyl-3-[[(methylamino)carbonyl]oxy]-, iodideCarbamic acid, [5-(dimethylethylammonio)-o-tolyl] ester, iodide
Database identifiers
- CAS
5464-66-4- PubChem CID
- 21620
- UNII
- LLT5NGX84G
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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