Basic information
- CAS
918637-54-4- Standard SMILES
CC(C)C/C=C/C=C/C(N)=O- InChIKey
CMXDNZFOOPLNCF-BDWKERMESA-N- Molecular formula
- C9H15NO
- Average molar mass
- 153.22 g/mol
- Monoisotopic mass
- 153.1153641
Overview
(2E,4E)-7-methylocta-2,4-dienoic acid amide is a carboxamide.
Names & identifiers
- Preferred name
- (2E,4E)-7-methylocta-2,4-dienoic acid amide
- IUPAC
- (2E,4E)-7-methylocta-2,4-dienamide
Names & synonyms
(2E,4E)-7-methylocta-2,4-dienoic acid amide(2E,4E)-7-METHYLOCTA-2,4-DIENAMIDERefChem:68773(2E,4E)-7-Methylocta-2,4-dienimidate(2E,4E)-7-Methylocta-2,4-dienoate amideCHEMBL463899CHEBI:202262
Database identifiers
- CAS
918637-54-4- PubChem CID
- 16099485
- ChEMBL
CHEMBL463899- ChEBI
CHEBI:202262- Nikkaji
- J2.419.371C
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 168
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…