A1H13
3,5,5-trimethylcyclohex-2-en-1-one
Find entries where: A1H13
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 3,5,5-trimethylcyclohex-2-en-1-one |
| Synonyms | Isophorone |
| Identifiers | 3,5,5-trimethylcyclohex-2-en-1-one |
| Formula | C9 H14 O |
| Molecular Weight | 138.207 |
| Type | NON-POLYMER |
| Isomeric SMILES | CC1=CC(=O)CC(C1)(C)C |
| InChI | InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3 |
| InChIKey | HJOVHMDZYOCNQW-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 24 |
| Chiral Atom Count | 0 |
| Bond Count | 24 |
| Aromatic Bond Count | 0 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 6544 |
| ChEMBL | CHEMBL1882894 |
| ChEBI | CHEBI:34800 |
