methyl 3-hydroxybutyrate (CAS 1487-49-6) — formula C5H10O3, molecular weight 118.13; category organic chemicals.
| CAS Number | 1487-49-6 |
|---|---|
| Molecular Formula | C5H10O3 |
| Molecular Weight | 118.13 |
| Boiling Point | 158.00 to 160.00 °C. @ 760.00 mm Hg |
| LogP | -0.2 |
| Category | Organic Chemicals |
methyl 3-hydroxybutyrate is a carbon-based organic compound with CAS registry number 1487-49-6 and molecular formula C5H10O3 (molecular weight 118.13), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1487-49-6
Its molecular formula C5H10O3 comprises 5 C, 10 H, 3 O atoms.
Also known as: methyl 3-hydroxybutyrate · 3-羟基丁酸甲酯
Category: organic chemicals
The CAS registry number of methyl 3-hydroxybutyrate is 1487-49-6.
Molecular formula C5H10O3, molecular weight 118.13.
It is also registered under: methyl 3-hydroxybutyrate, 3-羟基丁酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl 3-hydroxybutyrate (CAS 1487-49-6), compiled from public chemistry databases.
| CAS 号 | 1487-49-6 |
|---|---|
| PubChem CID | 15146 |
| 分子式 | C5H10O3 |
| IUPAC 名称 | methyl 3-hydroxybutanoate |
| UNII（FDA） | S36O46U3EA |
| FEMA 编号 | 4450 |
| JECFA 编号 | 1947 |
| Molecular Weight | 118.13 |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 118.062994177 |
| Monoisotopic Mass | 118.062994177 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 8 |
| Boiling Point | 158.00 to 160.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 158-160 °C |
| Density | 1.053-1.061 (20 °C) |
| Refractive Index | 1.417-1.425 |
Methyl 3-hydroxybutanoate; Methyl 3-hydroxybutyrate; 1487-49-6; Butanoic acid, 3-hydroxy-, methyl ester; Methyl-3-hydroxybutyrate; BUTYRIC ACID, 3-HYDROXY-, METHYL ESTER; EINECS 216-068-1; 3-hydroxybutyric acid methyl ester; UNII-S36O46U3EA; Methyl .beta.-hydroxybutyrate; methyl (RS)-3-hydroxybutyrate; S36O46U3EA; formyl 3-hydroxy-butanoate; CH3CH(OH)CH2C(O)OCH3; LDLDJEAVRNAEBW-UHFFFAOYSA-; DTXSID70862677
| 法规与食品接触 | FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FLAVOURING_AGENT: Flavouring Agent Flavoring Agents Fruit No safety concern at current levels of intake when used as a flavouring agent TRS 960-JECFA 73/71 |
|---|
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
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3-羟基丁酸甲酯 · CAS 1487-49-6 · C5H10O3. UNII S36O46U3EA. Boiling Point: 158.00 to 160.00 °C. @ 760.00 mm Hg; Boiling Point: 158-160 °C; Density: 1.053-1.061 (20 °C).
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-羟基丁酸甲酯