2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID (CAS 96017-10-6) — formula C17H15NO3, molecular weight 281.30; category organic chemicals.
2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID is a carbon-based organic compound with CAS registry number 96017-10-6 and molecular formula C17H15NO3 (molecular weight 281.30), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96017-10-6
Its molecular formula C17H15NO3 comprises 17 C, 15 H, 1 N, 3 O atoms.
Also known as: 2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID · 2-(1-氧代-2,3-二氢-1H-异吲哚-2-基)-3-苯基丙酸
Category: organic chemicals
The CAS registry number of 2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID is 96017-10-6.
Molecular formula C17H15NO3, molecular weight 281.30.
It is also registered under: 2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID, 2-(1-氧代-2,3-二氢-1H-异吲哚-2-基)-3-苯基丙酸.
Category: Organic Chemicals.
Public-database records for 2-(1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-3-PHENYLPROPANOIC ACID (CAS 96017-10-6), reproduced here for independent cross-checking.
| CAS 号 | 96017-10-6 |
|---|---|
| PubChem CID | 2764374 |
| 分子式 | C17H15NO3 |
| IUPAC 名称 | 2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoic acid |
| UNII(FDA) | HMS1366O20 |
96017-10-6; 2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoic acid; DTXSID20377423; RefChem:249838; DTXCID80328451; 2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-phenylpropanoic acid; 2-(1-Oxoisoindolin-2-yl)-3-phenylpropanoic acid; 2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoic acid; MFCD00664644; Bionet2_001032; Oprea1_401541; MLS000594384; SCHEMBL825642; CHEMBL1520585; HMS1366O20; HMS2314G13
| 分子量 | 281.30 |
|---|---|
| XLogP3 | 2.5 |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 4 |
| 精确质量 | 281.10519334 |
| 单同位素质量 | 281.10519334 |
| 拓扑极性表面积 | 57.6 |
| 重原子数 | 21 |
| 形式电荷 | 0 |
2-(1-氧代-2,3-二氢-1H-异吲哚-2-基)-3-苯基丙酸 · CAS 96017-10-6 · C17H15NO3. UNII HMS1366O20.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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