4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid (CAS 71872-96-3) — formula C11H10N2O6S, molecular weight 298.27; category organic chemicals.
| CAS Number | 71872-96-3 |
|---|---|
| Molecular Formula | C11H10N2O6S |
| Molecular Weight | 298.27 |
| LogP | -0.3 |
| Category | Organic Chemicals |
4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid is a carbon-based organic compound with CAS registry number 71872-96-3 and molecular formula C11H10N2O6S (molecular weight 298.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 71872-96-3
Its molecular formula C11H10N2O6S comprises 11 C, 10 H, 2 N, 6 O, 1 S atoms.
Also known as: 4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid · 4,5-二氢-5-氧代-1-(4-磺基苯基)-1H-吡唑-3-乙酸
Category: organic chemicals
The CAS registry number of 4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid is 71872-96-3.
Molecular formula C11H10N2O6S, molecular weight 298.27.
It is also registered under: 4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid, 4,5-二氢-5-氧代-1-(4-磺基苯基)-1H-吡唑-3-乙酸.
Category: Organic Chemicals.
Independent reference data for 4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid (CAS 71872-96-3), compiled from public chemistry databases.
| CAS 号 | 71872-96-3 |
|---|---|
| PubChem CID | 3018280 |
| 分子式 | C11H10N2O6S |
| IUPAC 名称 | 2-[5-oxo-1-(4-sulfophenyl)-4H-pyrazol-3-yl]acetic acid |
| UNII（FDA） | NS00062037 |
| Molecular Weight | 298.27 |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 298.02595722 |
| Monoisotopic Mass | 298.02595722 |
| Topological Polar Surface Area | 133 |
| Heavy Atom Count | 20 |
71872-96-3; EINECS 276-105-2; 4,5-Dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-acetic acid; DTXSID30992580; BQPLZHXIWFVFRH-UHFFFAOYSA-N; NS00062037; [5-Oxo-1-(4-sulfophenyl)-4,5-dihydro-1H-pyrazol-3-yl]acetic acid
4,5-二氢-5-氧代-1-(4-磺基苯基)-1H-吡唑-3-乙酸 · CAS 71872-96-3 · C11H10N2O6S. UNII NS00062037.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.