CAS Number23981-47-7
Synonyms(6-Methoxy-2-naphthyl)acetic acid; (6-methoxynaphthalen-2-yl)acetic acid; 6-Methoxy-2-naphthaleneacetic Acid; 2-(6-methoxynaphthalen-2-yl)acetic acid
Molecular FormulaC13H12O3
Molecular Weight216.23
Density1.2±0.1 g/cm3
Boiling Point408.8±20.0 °C at 760 mmHg
Melting Point171-173ºC
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 23981-47-7 |
| Catalog No. | 2A-9086025 |
| Chinese Name | 6-甲基萘乙酸 |
| Synonyms | (6-Methoxy-2-naphthyl)acetic acid; (6-methoxynaphthalen-2-yl)acetic acid; 6-Methoxy-2-naphthaleneacetic Acid; 2-(6-methoxynaphthalen-2-yl)acetic acid |
| Molecular Formula | C13H12O3 |
| Molecular Weight | 216.23 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 408.8±20.0 °C at 760 mmHg |
| Melting Point | 171-173ºC |
| Appearance | solid |
| Storage Condition | room temperature, dry |
| Application | α-Desmethylnaproxen is the main metabolite of nabumetone (HY-B0559), an orally active COX-2 inhibitor with anti-inflammatory activity [1][2]. |
| HTC | 2918990090 |
| MDL Number | MFCD00033105 |
| SMILES | O(C)c1cc2c(cc(cc2)CC(=O)O)cc1 |
| InChI | 1S/C13H12O3/c1-16-12-5-4-10-6-9(7-13(14)15)2-3-11(10)8-12/h2-6,8H,7H2,1H3,(H,14,15) |
| InChI Key | PHJFLPMVEFKEPL-UHFFFAOYSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/86025_1_23981_47_7.pdf |
| Use of | α-Demethylnaproxen is the major metabolite of Nabumetone (HY-B0559), Nabumetone is an orally active COX-2 inhibitor with anti-inflammatory activity[1][2]. Properties Name (6-methoxy-2-naphthyl)acetic acid Synonym More Synonyms 2-(6-Methoxynaphthalen-2-yl)acetic acid Biological Activity Description α-Demethylnaproxen is the major metabolite of Nabumetone (HY-B0559), Nabumetone is an orally active COX-2 inhibitor with anti-inflammatory activity[1][2]. Related Catalog Research Areas >> Inflammation/Immunology Chemical & Physical Properties Molecular Formula C13H12O3 Exact Mass 216.078644 PSA 46.53000 Index of Refraction 1.625 InChIKey PHJFLPMVEFKEPL-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 2-Naphthaleneacetic acid, 6-methoxy- CAS REGISTRY NUMBER : 23981-47-7 BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C13-H12-O3 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : L66J CO1 H1VQ HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 119,600,1980 Safety Information Hazard Codes Xi HS Code 2918990090 Synthetic Route 4-[2-(6-methoxy... 53077-21-7 2-(6-Methoxynap... 23981-47-7 Literature: Tetrahedron Letters, , vol. 50, # 31 p. 4541 - 4544 2--(6--methoxyn... 54828-56-7 2-(6-Methoxynap... 23981-47-7 Literature: ACS Medicinal Chemistry Letters, , vol. 3, # 9 p. 759 - 763 2-(6-methoxynap... 71056-96-7 2-(6-Methoxynap... 23981-47-7 Literature: Chemical Communications, , vol. 46, # 10 p. 1697 - 1699 Precursor & DownStream Precursor 10 CAS#:53077-21-7 4-[2-(6-methoxy... CAS#:54828-56-7 2--(6--methoxyn... CAS#:71056-96-7 2-(6-methoxynap... CAS#:23981-48-8 methyl 2-(6-met... DownStream 7 CAS#:52079-10-4 O-Desmethylnaproxen CAS#:23981-80-8 2-(6-Methoxynap... CAS#:3453-33-6 6-Methoxy-2-nap... CAS#:60201-22-1 6-Methoxy-2-nap... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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