1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester (CAS 51842-50-3) — formula C14H13NO4, molecular weight 259.26; category organic chemicals.
| CAS Number | 51842-50-3 |
|---|---|
| Molecular Formula | C14H13NO4 |
| Molecular Weight | 259.26 |
| LogP | 2.3 |
| Category | Organic Chemicals |
1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester is a carbon-based organic compound with CAS registry number 51842-50-3 and molecular formula C14H13NO4 (molecular weight 259.26), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 51842-50-3
Its molecular formula C14H13NO4 comprises 14 C, 13 H, 1 N, 4 O atoms.
Also known as: 1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester · 4-（1H-吲哚-3-基）-2,4-二氧代丁酸乙酯
Category: organic chemicals
The CAS registry number of 1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester is 51842-50-3.
Molecular formula C14H13NO4, molecular weight 259.26.
It is also registered under: 1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester, 4-（1H-吲哚-3-基）-2,4-二氧代丁酸乙酯.
Category: Organic Chemicals.
Independent reference data for 1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester (CAS 51842-50-3), compiled from public chemistry databases.
| CAS 号 | 51842-50-3 |
|---|---|
| PubChem CID | 604155 |
| 分子式 | C14H13NO4 |
| IUPAC 名称 | ethyl 4-(1H-indol-3-yl)-2,4-dioxobutanoate |
| UNII（FDA） | ST50989860 |
| Molecular Weight | 259.26 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 259.08445790 |
| Monoisotopic Mass | 259.08445790 |
| Topological Polar Surface Area | 76.2 |
| Heavy Atom Count | 19 |
Ethyl 4-(1H-indol-3-yl)-2,4-dioxobutanoate; 51842-50-3; MFCD01101510; 1H-indole-3-butanoic acid, alpha,gamma-dioxo-, ethyl ester; SCHEMBL20913000; KHBIPUCDJHOGEE-UHFFFAOYSA-N; ALBB-012794; BBL015961; STL163933; AKOS004115313; ethyl 4-indol-3-yl-2,4-dioxobutanoate; VS-05081; CS-0317689; ST50989860; Ethyl4-(1H-indol-3-yl)-2,4-dioxobutanoate; H30119
4-（1H-吲哚-3-基）-2,4-二氧代丁酸乙酯 · CAS 51842-50-3 · C14H13NO4. UNII ST50989860.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.