4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID (CAS 5333-34-6) — formula C12H14O5, molecular weight 238.24; category organic chemicals.
4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID is a carbon-based organic compound with CAS registry number 5333-34-6 and molecular formula C12H14O5 (molecular weight 238.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5333-34-6
Its molecular formula C12H14O5 comprises 12 C, 14 H, 5 O atoms.
Also known as: 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID · 3-(3,4-二甲氧基苯甲酰)丙酸, 98%
Category: organic chemicals
The CAS registry number of 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID is 5333-34-6.
Molecular formula C12H14O5, molecular weight 238.24.
It is also registered under: 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID, 3-(3,4-二甲氧基苯甲酰)丙酸, 98%.
Category: Organic Chemicals.
Public-database records for 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID (CAS 5333-34-6), reproduced here for independent cross-checking.
| 已通报的危害声明 | H302 (14.3%), H315 (85.7%), H319 (85.7%), H335 (85.7%) |
|---|
| CAS 号 | 5333-34-6 |
|---|---|
| PubChem CID | 219390 |
| 分子式 | C12H14O5 |
| IUPAC 名称 | 4-(3,4-dimethoxyphenyl)-4-oxobutanoic acid |
4-(3,4-dimethoxyphenyl)-4-oxobutanoic acid; RefChem:512866; 675-326-5; 5333-34-6; 4-(3,4-Dimethoxyphenyl)-4-oxobutyric acid; 3-(3,4-dimethoxybenzoyl)propionic acid; MFCD00033286; 4-(3,4-dimethoxyphenyl)-4-oxo-butanoic acid; 60890-29-1; 3-veratroylpropionic acid; NSC625; SCHEMBL1527427; SCHEMBL29923058; DTXSID20277070; NSC-625; AKOS000117614
| 分子量 | 238.24 |
|---|---|
| XLogP3 | 1 |
| 氢键供体数 | 1 |
| 氢键受体数 | 5 |
| 可旋转键数 | 6 |
| 精确质量 | 238.08412354 |
| 单同位素质量 | 238.08412354 |
| 拓扑极性表面积 | 72.8 |
| 重原子数 | 17 |
| 形式电荷 | 0 |
3-(3,4-二甲氧基苯甲酰)丙酸, 98% · CAS 5333-34-6 · C12H14O5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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