4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one (CAS 4687-77-8) — formula C12H18O, molecular weight 178.27; category organic chemicals.
| CAS Number | 4687-77-8 |
|---|---|
| Molecular Formula | C12H18O |
| Molecular Weight | 178.27 |
| LogP | 2.4 |
| Category | Organic Chemicals |
4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one is a carbon-based organic compound with CAS registry number 4687-77-8 and molecular formula C12H18O (molecular weight 178.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4687-77-8
Its molecular formula C12H18O comprises 12 C, 18 H, 1 O atoms.
Also known as: 4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one · 4-(2,4-二甲基-3-环己烯-1-基)-3-丁烯-2-酮
Category: organic chemicals
The CAS registry number of 4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one is 4687-77-8.
Molecular formula C12H18O, molecular weight 178.27.
It is also registered under: 4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one, 4-(2,4-二甲基-3-环己烯-1-基)-3-丁烯-2-酮.
Category: Organic Chemicals.
Independent reference data for 4-(2,4-dimethyl-3-cyclohexen-1-yl)-3-buten-2-one (CAS 4687-77-8), compiled from public chemistry databases.
| CAS 号 | 4687-77-8 |
|---|---|
| PubChem CID | 107575 |
| 分子式 | C12H18O |
| IUPAC 名称 | 4-(2,4-dimethylcyclohex-3-en-1-yl)but-3-en-2-one |
| UNII（FDA） | NS00047418 |
| Molecular Weight | 178.27 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 178.135765193 |
| Monoisotopic Mass | 178.135765193 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 13 |
RAGGPHXESKFCRO-UHFFFAOYSA-N; NS00047418; 4-(2,4-dimethylcyclohex-3-en-1-yl)but-3-en-2-one
4-(2,4-二甲基-3-环己烯-1-基)-3-丁烯-2-酮 · CAS 4687-77-8 · C12H18O. UNII NS00047418.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.