RefChem:438467
3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate
Also Known As: EINECS 267-569-7|1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-, inner salt|3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate|1-(2-Carboxylatoethyl)-2-(heptadec-8-enyl)-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium|1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl) -4,5-dihydro-1-(2-hydroxyethyl)-, hydroxide, inner salt|1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyeth- yl)-, hydroxide, inner salt|1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-, hydroxide, inner salt|3-[2-(Heptadec-8-en-1-yl)-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium-1-yl]propanoate
| Molecular Formula | C25H46N2O3 |
|---|---|
| Molecular Weight | 422.35083 g/mol |
| LogP | 4.39 |
| Topological Polar Surface Area | 72.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 422.35083 |
| Heavy Atoms | 30 |
| Complexity | 504.6 |
Chemical Identifiers
| CAS Number | 67892-37-9 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC1=NCC[N+]1(CCC(=O)[O-])CCO |
Product Overview
RefChem:438467 (CAS 67892-37-9), with molecular formula C25H46N2O3 and molecular weight 422.35083 g/mol. IUPAC: 3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate.
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