3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole (CAS 13312-40-8) — formula C13H13N3O4, molecular weight 275.26; category organic chemicals.
| CAS Number | 13312-40-8 |
|---|---|
| Molecular Formula | C13H13N3O4 |
| Molecular Weight | 275.26 |
| LogP | 2.4 |
| Category | Organic Chemicals |
3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole is a carbon-based organic compound with CAS registry number 13312-40-8 and molecular formula C13H13N3O4 (molecular weight 275.26), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13312-40-8
Its molecular formula C13H13N3O4 comprises 13 C, 13 H, 3 N, 4 O atoms.
Also known as: 3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole · 3,5-二甲基-1-[(4-硝基苯氧基)乙酰基]-1H-吡唑
Category: organic chemicals
The CAS registry number of 3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole is 13312-40-8.
Molecular formula C13H13N3O4, molecular weight 275.26.
It is also registered under: 3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole, 3,5-二甲基-1-[(4-硝基苯氧基)乙酰基]-1H-吡唑.
Category: Organic Chemicals.
Independent reference data for 3,5-dimethyl-1-[(4-nitrophenoxy)acetyl]-1H-pyrazole (CAS 13312-40-8), compiled from public chemistry databases.
| CAS 号 | 13312-40-8 |
|---|---|
| PubChem CID | 675601 |
| 分子式 | C13H13N3O4 |
| IUPAC 名称 | 1-(3,5-dimethylpyrazol-1-yl)-2-(4-nitrophenoxy)ethanone |
| UNII（FDA） | HMS2555I07 |
| Molecular Weight | 275.26 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 275.09060590 |
| Monoisotopic Mass | 275.09060590 |
| Topological Polar Surface Area | 89.9 |
| Heavy Atom Count | 20 |
13312-40-8; 1-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(4-nitrophenoxy)ethanone; 1-(3,5-dimethylpyrazol-1-yl)-2-(4-nitrophenoxy)ethanone; 1-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(4-nitrophenoxy)ethan-1-one; 1-({4-nitrophenoxy}acetyl)-3,5-dimethyl-1H-pyrazole; MLS000701424; CHEMBL1308184; HMS2555I07; STK070202; AKOS000490864; SMR000228740; ST054486; AN-329/40839996; SR-01000012725; SR-01000012725-1; F1443-0761
3,5-二甲基-1-[(4-硝基苯氧基)乙酰基]-1H-吡唑 · CAS 13312-40-8 · C13H13N3O4. UNII HMS2555I07.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.