4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID (CAS 81282-82-8) — formula C12H12N2O2, molecular weight 216.24; category organic chemicals.
| CAS Number | 81282-82-8 |
|---|---|
| Molecular Formula | C12H12N2O2 |
| Molecular Weight | 216.24 |
| LogP | 2.2 |
| Category | Organic Chemicals |
4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID is a carbon-based organic compound with CAS registry number 81282-82-8 and molecular formula C12H12N2O2 (molecular weight 216.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81282-82-8
Its molecular formula C12H12N2O2 comprises 12 C, 12 H, 2 N, 2 O atoms.
Also known as: 4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID · 4-(3,5-二甲基-1H-吡唑-1-基)苯甲酸
Category: organic chemicals
The CAS registry number of 4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID is 81282-82-8.
Molecular formula C12H12N2O2, molecular weight 216.24.
It is also registered under: 4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID, 4-(3,5-二甲基-1H-吡唑-1-基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 4-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID (CAS 81282-82-8), compiled from public chemistry databases.
| CAS 号 | 81282-82-8 |
|---|---|
| PubChem CID | 693206 |
| 分子式 | C12H12N2O2 |
| IUPAC 名称 | 4-(3,5-dimethylpyrazol-1-yl)benzoic acid |
| UNII（FDA） | HMS1408B18 |
| Molecular Weight | 216.24 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 216.089877630 |
| Monoisotopic Mass | 216.089877630 |
| Topological Polar Surface Area | 55.1 |
| Heavy Atom Count | 16 |
4-(3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid; 81282-82-8; DTXSID40351200; RefChem:287502; DTXCID90302267; 630-116-2; 4-(3,5-dimethylpyrazol-1-yl)benzoic acid; 4-(3,5-Dimethyl-pyrazol-1-yl)-benzoic acid; MFCD03011525; F1930-0020; 4-(3,5-dimethylpyrazolyl)benzoic acid; Enamine_004968; MLS000553500; CHEMBL1880889; LXNGKWBJIIXNBD-UHFFFAOYSA-N; HMS1408B18
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
4-(3,5-二甲基-1H-吡唑-1-基)苯甲酸 · CAS 81282-82-8 · C12H12N2O2. UNII HMS1408B18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-(3,5-二甲基-1H-吡唑-1-基)苯甲酸