3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID (CAS 402720-00-7) — formula C11H8ClN3O4, molecular weight 281.65; category organic chemicals.
| CAS Number | 402720-00-7 |
|---|---|
| Molecular Formula | C11H8ClN3O4 |
| Molecular Weight | 281.65 |
| LogP | 2.1 |
| Category | Organic Chemicals |
3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID is a carbon-based organic compound with CAS registry number 402720-00-7 and molecular formula C11H8ClN3O4 (molecular weight 281.65), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 402720-00-7
Its molecular formula C11H8ClN3O4 comprises 11 C, 8 H, 1 Cl, 3 N, 4 O atoms.
Also known as: 3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID · 3-((4-氯-3-硝基-1H-吡唑-1-基)甲基)苯甲酸
Category: organic chemicals
The CAS registry number of 3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID is 402720-00-7.
Molecular formula C11H8ClN3O4, molecular weight 281.65.
It is also registered under: 3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID, 3-((4-氯-3-硝基-1H-吡唑-1-基)甲基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID (CAS 402720-00-7), compiled from public chemistry databases.
| CAS 号 | 402720-00-7 |
|---|---|
| PubChem CID | 840108 |
| 分子式 | C11H8ClN3O4 |
| IUPAC 名称 | 3-[(4-chloro-3-nitropyrazol-1-yl)methyl]benzoic acid |
| UNII（FDA） | ST45161423 |
| Molecular Weight | 281.65 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 281.0203334 |
| Monoisotopic Mass | 281.0203334 |
| Topological Polar Surface Area | 101 |
| Heavy Atom Count | 19 |
402720-00-7; 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid; 3-((4-chloro-3-nitro-1h-pyrazol-1-yl)methyl)benzoic acid; 3-[(4-chloro-3-nitropyrazolyl)methyl]benzoic acid; MFCD01114894; 3-((4-chloro-3-nitro-1h-pyrazol-1-yl)methyl)benzoicacid; 3-({4-chloro-3-nitro-1H-pyrazol-1-yl}methyl)benzoicacid; 3-[(4-chloro-3-nitropyrazol-1-yl)methyl]benzoic acid; Oprea1_376528; AK-968/37166215; 3-(4-Chloro-3-nitro-pyrazol-1-ylmethyl)-benzoic acid; CRA72000; SBB019685; STK346643; AKOS000304324; CS-0269074
3-((4-氯-3-硝基-1H-吡唑-1-基)甲基)苯甲酸 · CAS 402720-00-7 · C11H8ClN3O4. UNII ST45161423.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.