2-(2-Heptadec-8-enyl-4,5-dihydroimidazol-1-yl)ethanamine;2-hydroxyacetic acid
Basic information
- CAS
68083-46-5- Standard SMILES
CCCCCCCCC=CCCCCCCCC1=NCCN1CCN.O=C(O)CO- InChIKey
HWYYGXDZVLQRPT-UHFFFAOYSA-N- Molecular formula
- C24H47N3O3
- Average molar mass
- 425.6 g/mol
- Monoisotopic mass
- 425.36174237
Names & identifiers
- Preferred name
- 2-(2-Heptadec-8-enyl-4,5-dihydroimidazol-1-yl)ethanamine;2-hydroxyacetic acid
- IUPAC
- 2-(2-heptadec-8-enyl-4,5-dihydroimidazol-1-yl)ethanamine;2-hydroxyacetic acid
Names & synonyms
NS00091446
Database identifiers
- CAS
68083-46-5- PubChem CID
- 106516
- DTXSID
DTXSID3071060
Properties
Computed structural properties
- Topological polar surface area
- 99.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 18
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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