2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID (CAS 96296-39-8) — formula C13H13NO4, molecular weight 247.25; category organic chemicals.
| CAS Number | 96296-39-8 |
|---|---|
| Molecular Formula | C13H13NO4 |
| Molecular Weight | 247.25 |
| LogP | 2.3 |
| Category | Organic Chemicals |
2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID is a carbon-based organic compound with CAS registry number 96296-39-8 and molecular formula C13H13NO4 (molecular weight 247.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96296-39-8
Its molecular formula C13H13NO4 comprises 13 C, 13 H, 1 N, 4 O atoms.
Also known as: 2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID · 2-丁基-1,3-二氧代-2,3-二氢-1H-异吲哚-5-羧酸
Category: organic chemicals
The CAS registry number of 2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID is 96296-39-8.
Molecular formula C13H13NO4, molecular weight 247.25.
It is also registered under: 2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID, 2-丁基-1,3-二氧代-2,3-二氢-1H-异吲哚-5-羧酸.
Category: Organic Chemicals.
Independent reference data for 2-BUTYL-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID (CAS 96296-39-8), compiled from public chemistry databases.
| CAS 号 | 96296-39-8 |
|---|---|
| PubChem CID | 2434770 |
| 分子式 | C13H13NO4 |
| IUPAC 名称 | 2-butyl-1,3-dioxoisoindole-5-carboxylic acid |
| UNII（FDA） | HMS1788O01 |
| Molecular Weight | 247.25 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 247.08445790 |
| Monoisotopic Mass | 247.08445790 |
| Topological Polar Surface Area | 74.7 |
| Heavy Atom Count | 18 |
96296-39-8; 2-butyl-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid; 2-Butyl-1,3-dioxoisoindoline-5-carboxylic acid; 2-butyl-1,3-dioxoisoindole-5-carboxylic acid; MFCD02905198; 1H-Isoindole-5-carboxylicacid, 2-butyl-2,3-dihydro-1,3-dioxo-; Oprea1_093421; SCHEMBL14560525; DTXSID80368650; HMS1788O01; WDA29639; STK894885; AKOS005609819; SB65654; CS-0219737; EN300-04823
| 已通报的危害声明 | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
2-丁基-1,3-二氧代-2,3-二氢-1H-异吲哚-5-羧酸 · CAS 96296-39-8 · C13H13NO4. UNII HMS1788O01.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.