Basic information
- CAS
14350-95-9- Standard SMILES
CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC(=O)O.[OH-]- InChIKey
ZIMZTOXPQHOFRU-UHFFFAOYSA-N- Molecular formula
- C24H48N2O4
- Average molar mass
- 428.6 g/mol
- Monoisotopic mass
- 428.36140802
Names & identifiers
- Preferred name
- 1-(Carboxymethyl)-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1h-imidazol-1-ium hydroxide
- IUPAC
- 2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid hydroxide
Names & synonyms
1-(carboxymethyl)-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1h-imidazol-1-ium hydroxide14350-95-9EINECS 238-304-21-(Carboxymethyl)-2-heptadecyl-1-(2-hydroxyethyl)imidazolin-2-ium hydroxideAKOS0302548102-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid;hydroxide
Database identifiers
- CAS
14350-95-9- PubChem CID
- 84371
- EC Number
- 238-304-2
Properties
Computed structural properties
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 20
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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