Rofecoxib (CAS 162011-90-7) — formula C17H14O4S, molecular weight 314.4; category fertilizers.
Rofecoxib (CAS 162011-90-7) is a chemical raw material in the fertilizers category. Its molecular formula C17H14O4S comprises 17 C, 14 H, 4 O, 1 S atoms. Its molecular weight is about 314.4. Reported physicochemical data: LogP about 3.2. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 162011-90-7 |
|---|---|
| Molecular Formula | C17H14O4S |
| Molecular Weight | 314.4 |
| LogP | 3.2 |
| Applications | Medication: anti-inflammatory, Use (kg) in USA (2002): 13900, Consumption (g per capita) in the USA (2002): 0.0493, Calculated removal (%): 22.3, Pharmaceuticals, Methods of Manufacturing: Condensation of phenylacetic acid with ethyl bromoacetate in the presence of triethylamine in THF yields ethyl 2-(phenylacetoxy)acetate |
| Category | Fertilizers |
Documented applications: Medication: anti-inflammatory, Use (kg) in USA (2002): 13900, Consumption (g per capita) in the USA (2002): 0.0493, Calculated removal (%): 22.3, Pharmaceuticals, Methods of Manufacturing: Condensation of phenylacetic acid with ethyl bromoacetate in the presence of triethylamine in THF yields ethyl 2-(phenylacetoxy)acetate.
Rofecoxib is a fertilizer compound with CAS registry number 162011-90-7 and molecular formula C17H14O4S (molecular weight 314.4), belonging to the fertilizers segment of chemical raw materials.
CAS number: 162011-90-7
Its molecular formula C17H14O4S comprises 17 C, 14 H, 4 O, 1 S atoms.
Also known as: Rofecoxib
Category: fertilizers
The CAS registry number of Rofecoxib is 162011-90-7.
Molecular formula C17H14O4S, molecular weight 314.4.
It is also registered under: Rofecoxib.
Recorded applications: Medication: anti-inflammatory, Use (kg) in USA (2002): 13900, Consumption (g per capita) in the USA (2002): 0.0493, Calculated removal (%): 22.3, Pharmaceuticals, Methods of Manufacturing: Condensation of phenylacetic acid with ethyl bromoacetate in the presence of triethylamine in THF yields ethyl 2-(phenylacetoxy)acetate.
Category: Fertilizers.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Rofecoxib (CAS 162011-90-7), compiled from public chemistry databases.
| CAS Registry Number | 162011-90-7 |
|---|---|
| PubChem CID | 5090 |
| Molecular formula | C17H14O4S |
| IUPAC name | 3-(4-methylsulfonylphenyl)-4-phenyl-2H-furan-5-one |
| UNII (FDA) | 0QTW8Z7MCR |
| Molecular Weight | 314.4 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 314.06128010 |
| Monoisotopic Mass | 314.06128010 |
| Topological Polar Surface Area | 68.8 |
| Heavy Atom Count | 22 |
| LogP | 3.2 |
|---|
rofecoxib; 162011-90-7; Vioxx; Ceoxx; 4-(4-(Methylsulfonyl)phenyl)-3-phenylfuran-2(5H)-one; MK 966; MK-966; 4-[4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one; Vioxx Dolor; 4-[4-(methylsulfonyl)phenyl]-3-phenyl-2(5H)-furanone; MK-0966; MK0966; rofecoxibum; DTXSID2023567; TRM-201; 0QTW8Z7MCR
| Reported hazard statements | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Rofecoxib · CAS 162011-90-7 · C17H14O4S. UNII 0QTW8Z7MCR. LogP: 3.2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: Rofecoxib