Acetoacetic Acid (CAS 541-50-4) — formula C4H6O3, molecular weight 102.09; category organic chemicals.
| CAS Number | 541-50-4 |
|---|---|
| Molecular Formula | C4H6O3 |
| Molecular Weight | 102.09 |
| Melting Point | 36.5 |
| Boiling Point | 237.00 to 239.00 °C. @ 760.00 mm Hg |
| LogP | -0.4 |
| Category | Organic Chemicals |
Acetoacetic Acid is a carbon-based organic compound with CAS registry number 541-50-4 and molecular formula C4H6O3 (molecular weight 102.09), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 541-50-4
Its molecular formula C4H6O3 comprises 4 C, 6 H, 3 O atoms.
Also known as: Acetoacetic Acid · 乙酰乙酸锂
Category: organic chemicals
The CAS registry number of Acetoacetic Acid is 541-50-4.
Molecular formula C4H6O3, molecular weight 102.09.
It is also registered under: Acetoacetic Acid, 乙酰乙酸锂.
Category: Organic Chemicals.
Independent reference data for Acetoacetic Acid (CAS 541-50-4), compiled from public chemistry databases.
| PubChem CID | 96 |
|---|---|
| 分子式 | C4H6O3 |
| IUPAC 名称 | 3-oxobutanoic acid |
| UNII（FDA） | 4ZI204Y1MC |
| Molecular Weight | 102.09 |
|---|---|
| XLogP3 | -0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 102.031694049 |
| Monoisotopic Mass | 102.031694049 |
| Topological Polar Surface Area | 54.4 |
| Heavy Atom Count | 7 |
| Boiling Point | 237.00 to 239.00 °C. @ 760.00 mm Hg |
|---|---|
| Melting Point | 36.5 |
| Melting Point | 36.5 °C |
| Solubility | 1000000 |
| Solubility | 1000 mg/mL at 20 °C |
| Dissociation Constants | 3.59 (at 0 °C) |
acetoacetic acid; 3-oxobutanoic acid; 541-50-4; 3-oxobutyric acid; beta-ketobutyric acid; diacetic acid; Butanoic acid, 3-oxo-; 3-Ketobutyric acid; 3-oxo-butanoic acid; 3-ketobutanoic acid; 4ZI204Y1MC; CHEBI:15344; DTXSID00202441; RefChem:5508; DTXCID00124932; 3-ketobutyrate
乙酰乙酸锂 · C4H6O3. UNII 4ZI204Y1MC. Boiling Point: 237.00 to 239.00 °C. @ 760.00 mm Hg; Melting Point: 36.5; Melting Point: 36.5 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 乙酰乙酸锂