Hexobarbital (CAS 56-29-1) — formula C12H16N2O3, molecular weight 236.27; category organic chemicals.
| CAS Number | 56-29-1 |
|---|---|
| Molecular Formula | C12H16N2O3 |
| Molecular Weight | 236.27 |
| Melting Point | 146.5 |
| LogP | 1.98 |
| Category | Organic Chemicals |
Hexobarbital is a carbon-based organic compound with CAS registry number 56-29-1 and molecular formula C12H16N2O3 (molecular weight 236.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 56-29-1
Its molecular formula C12H16N2O3 comprises 12 C, 16 H, 2 N, 3 O atoms.
Also known as: Hexobarbital · 己巴比妥
Category: organic chemicals
The CAS registry number of Hexobarbital is 56-29-1.
Molecular formula C12H16N2O3, molecular weight 236.27.
It is also registered under: Hexobarbital, 己巴比妥.
Category: Organic Chemicals.
Independent reference data for Hexobarbital (CAS 56-29-1), compiled from public chemistry databases.
| CAS Registry Number | 56-29-1 |
|---|---|
| PubChem CID | 3608 |
| Molecular formula | C12H16N2O3 |
| IUPAC name | 5-(cyclohexen-1-yl)-1,5-dimethyl-1,3-diazinane-2,4,6-trione |
| UNII (FDA) | AL8Z8K3P6S |
| Molecular Weight | 236.27 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 236.11609238 |
| Monoisotopic Mass | 236.11609238 |
| Topological Polar Surface Area | 66.5 |
| Heavy Atom Count | 17 |
| Melting Point | 146.5 |
|---|---|
| Melting Point | 67.00 °C. @ 760.00 mm Hg |
| Solubility | 435 |
| Solubility | 1.51e+00 g/L |
| LogP | 1.98 |
| LogP | 1.71 |
| Dissociation Constants | 8.2 |
Hexobarbital; Hexobarbitone; Methexenyl; Methylhexabital; 56-29-1; Evipal; Evipan; Sombucaps; Sombulex; Enhexymal; Hexobarbitalum; Hexobarbitonum; 5-(1-CYCLOHEXEN-1-YL)-1,5-DIMETHYLBARBITURIC ACID; Hexobarbital ciii; DTXSID9023122; 5-(1-Cyclohexen-1-yl)-1,5-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Reported hazard statements | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Hexobarbital · CAS 56-29-1 · C12H16N2O3. UNII AL8Z8K3P6S. Melting Point: 146.5; Melting Point: 67.00 °C. @ 760.00 mm Hg; Solubility: 435.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 己巴比妥