4-(2-carboxyindol-3-yl)butyric acid (CAS 31529-29-0) — formula C13H13NO4, molecular weight 247.25; category organic chemicals.
| CAS Number | 31529-29-0 |
|---|---|
| Molecular Formula | C13H13NO4 |
| Molecular Weight | 247.25 |
| LogP | 2 |
| Category | Organic Chemicals |
4-(2-carboxyindol-3-yl)butyric acid is a carbon-based organic compound with CAS registry number 31529-29-0 and molecular formula C13H13NO4 (molecular weight 247.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 31529-29-0
Its molecular formula C13H13NO4 comprises 13 C, 13 H, 1 N, 4 O atoms.
Also known as: 4-(2-carboxyindol-3-yl)butyric acid · 4-(2-羧基吲哚-3-基)丁酸
Category: organic chemicals
The CAS registry number of 4-(2-carboxyindol-3-yl)butyric acid is 31529-29-0.
Molecular formula C13H13NO4, molecular weight 247.25.
It is also registered under: 4-(2-carboxyindol-3-yl)butyric acid, 4-(2-羧基吲哚-3-基)丁酸.
Category: Organic Chemicals.
Independent reference data for 4-(2-carboxyindol-3-yl)butyric acid (CAS 31529-29-0), compiled from public chemistry databases.
| CAS 号 | 31529-29-0 |
|---|---|
| PubChem CID | 169314 |
| 分子式 | C13H13NO4 |
| IUPAC 名称 | 3-(3-carboxypropyl)-1H-indole-2-carboxylic acid |
| UNII（FDA） | NS00029122 |
| Molecular Weight | 247.25 |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 247.08445790 |
| Monoisotopic Mass | 247.08445790 |
| Topological Polar Surface Area | 90.4 |
| Heavy Atom Count | 18 |
4-(2-Carboxyindol-3-yl)butyric acid; 1H-Indole-3-butanoic acid, 2-carboxy-; EINECS 250-682-0; RefChem:438716; 250-682-0; 31529-29-0; 2-Carboxyindole-3-butyric acid; 3-(3-carboxypropyl)-1H-indole-2-carboxylic acid; CHEMBL23611; 2-carboxy-3-indolebutyric acid; SCHEMBL3276610; DTXSID5067631; IAFOXRHFSQERNU-UHFFFAOYSA-N; AKOS004114724; NS00029122; 3-(3-carboxypropyl)-1H-indole-2-carboxylicacid
| 已通报的危害声明 | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
4-(2-羧基吲哚-3-基)丁酸 · CAS 31529-29-0 · C13H13NO4. UNII NS00029122.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-(2-羧基吲哚-3-基)丁酸