acetic acid;N-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl]acetamide
Basic information
- CAS
5419-29-4- Standard SMILES
CC(=O)O.CCCCCCCCCCCCCCCCCC1=NCCN1CCNC(C)=O- InChIKey
CCMGALJTUPPTSE-UHFFFAOYSA-N- Molecular formula
- C26H51N3O3
- Average molar mass
- 453.7 g/mol
- Monoisotopic mass
- 453.3930425
Names & identifiers
- Preferred name
- acetic acid;N-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl]acetamide
- IUPAC
- acetic acid;N-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl]acetamide
Names & synonyms
5419-29-4NSC9680DTXSID80969146NSC-9680NSC58287NSC-58287Acetic acid--N-[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl]ethanimidic acid (1/1)
Database identifiers
- CAS
5419-29-4- PubChem CID
- 222782
- DTXSID
DTXSID80969146
Properties
Computed structural properties
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 19
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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