3-Hydroxybutyric acid (CAS 300-85-6) — formula C4H8O3, molecular weight 104.10; category organic chemicals.
3-Hydroxybutyric acid is a carbon-based organic compound with CAS registry number 300-85-6 and molecular formula C4H8O3 (molecular weight 104.10), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 300-85-6
Its molecular formula C4H8O3 comprises 4 C, 8 H, 3 O atoms.
Also known as: 3-Hydroxybutyric acid · DL-3-Hydroxy-n-butyric Acid
Category: organic chemicals
The CAS registry number of 3-Hydroxybutyric acid is 300-85-6.
Molecular formula C4H8O3, molecular weight 104.10.
It is also registered under: 3-Hydroxybutyric acid, DL-3-Hydroxy-n-butyric Acid.
Category: Organic Chemicals.
Public-database records for 3-Hydroxybutyric acid (CAS 300-85-6), reproduced here for independent cross-checking.
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
| Regulatory & Food Contact | FDA Cumulative Estimated Daily Intake (CEDI): FCS 3-HYDROXY BUTANOIC ACID |
|---|
| Collision Cross Section | 137.1 Ų [M-H]- |
|---|
| CAS Registry Number | 300-85-6 |
|---|---|
| PubChem CID | 441 |
| 分子式 | C4H8O3 |
| IUPAC 名称 | 3-hydroxybutanoic acid |
| UNII（FDA） | TZP1275679 |
3-hydroxybutyric acid; 3-hydroxybutanoic acid; 300-85-6; Butanoic acid, 3-hydroxy-; beta-Hydroxybutyric acid; 3 HBA; 3-Hydroxybuttersaeure; beta-Hydroxybuttersaeure; DL-beta-Hydroxybutyric acid; beta-Hydroxy-n-butyric acid; 3-hydroxy-butanoic acid; beta-hydroxy-butyrate; (1)-3-Hydroxybutyric acid; Hydroxybutyric acid, dl-; NSC-3806; TZP1275679
| 分子量 | 104.10 |
|---|---|
| XLogP3 | -0.5 |
| 氢键供体数 | 2 |
| 氢键受体数 | 3 |
| 可旋转键数 | 2 |
| 精确质量 | 104.047344113 |
| 单同位素质量 | 104.047344113 |
| 拓扑极性表面积 | 57.5 |
| 重原子数 | 7 |
| 形式电荷 | 0 |
3-Hydroxybutyric acid · CAS 300-85-6 · C4H8O3. UNII TZP1275679. Collision Cross Section: 137.1 Ų [M-H]-.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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