Ammonium, allyldiethyl(((2,4,6-trimethylphenyl)carbamoyl)methyl)-
Basic information
- CAS
84213-91-2- Standard SMILES
C=CC[N+](CC)(CC)CC(=O)Nc1c(C)cc(C)cc1C- InChIKey
OYAIYZSRUKCRIR-UHFFFAOYSA-O- Molecular formula
- C18H29N2O+
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.22798855
Names & identifiers
- Preferred name
- Ammonium, allyldiethyl(((2,4,6-trimethylphenyl)carbamoyl)methyl)-
- IUPAC
- diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-enylazanium
Names & synonyms
84213-91-2AMMONIUM, ALLYLDIETHYL(((2,4,6-TRIMETHYLPHENYL)CARBAMOYL)METHYL)-Allyldiethyl(((2,4,6-trimethylphenyl)carbamoyl)methyl)ammoniumDTXSID60233135RefChem:319156DTXCID601556262-Propen-1-aminium, N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-(10CI)N,N-Diethyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]prop-2-en-1-aminium2-Propen-1-aminium, N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-
Database identifiers
- CAS
84213-91-2- PubChem CID
- 55208
- DTXSID
DTXSID60233135
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 1
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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