(1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER (CAS 51079-10-8) — formula C12H11NO3, molecular weight 217.22; category organic chemicals.
(1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER is a carbon-based organic compound with CAS registry number 51079-10-8 and molecular formula C12H11NO3 (molecular weight 217.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 51079-10-8
Its molecular formula C12H11NO3 comprises 12 C, 11 H, 1 N, 3 O atoms.
Also known as: (1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER · 3-吲哚乙醛酸乙酯
Category: organic chemicals
The CAS registry number of (1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER is 51079-10-8.
Molecular formula C12H11NO3, molecular weight 217.22.
It is also registered under: (1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER, 3-吲哚乙醛酸乙酯.
Category: Organic Chemicals.
Public-database records for (1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER (CAS 51079-10-8), reproduced here for independent cross-checking.
| 已通报的危害声明 | H319 (100%) |
|---|
| CAS 号 | 51079-10-8 |
|---|---|
| PubChem CID | 101242 |
| 分子式 | C12H11NO3 |
| IUPAC 名称 | ethyl 2-(1H-indol-3-yl)-2-oxoacetate |
| UNII（FDA） | 6U8Q4H6QFU |
51079-10-8; ethyl 2-(1H-indol-3-yl)-2-oxoacetate; Ethyl indol-3-ylglyoxylate; ETHYL 3-INDOLYLGLYOXYLATE; Ethyl indole-3-glyoxylate; 6U8Q4H6QFU; NSC-402543; DTXSID40199083; NSC 402543; ETHYL .ALPHA.-OXO-1H-INDOLE-3-ACETATE; RefChem:200852; DTXCID70121574; ETHYL ALPHA-OXO-1H-INDOLE-3-ACETATE; WTPMFFQBDYIARF-UHFFFAOYSA-N; (1H-Indol-3-yl)-oxo-acetic acid ethyl ester; ETHYL 2-(INDOL-3-YL)-2-OXOACETATE
| 分子量 | 217.22 |
|---|---|
| XLogP3 | 2.9 |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 4 |
| 精确质量 | 217.07389321 |
| 单同位素质量 | 217.07389321 |
| 拓扑极性表面积 | 59.2 |
| 重原子数 | 16 |
| 形式电荷 | 0 |
3-吲哚乙醛酸乙酯 · CAS 51079-10-8 · C12H11NO3. UNII 6U8Q4H6QFU.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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