Rofecoxib

Suppliers

Names

[ CAS No. ]:
162011-90-7

[ Name ]:
Rofecoxib

[Synonym ]:
Rofecoxid
4-(p-(Methylsulfonyl)phenyl)-3-phenyl-2(5H)-furanone
Rofecoxib
2(5H)-Furanone, 4-[4-(methyl-sulfonyl)phenyl]-3-phenyl-
4-[4-(MethylSLdfonyl)phenyl]-3-phenyl-2(5H)-furanone
4-[4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one
4-[4-(Methylsulfonyl)phenyl]-3-phenyl-2(5H)-furanone
3-[phenyl-4-(4-methylsulphonyl)phenyl]-2-(5H)-furanone
2(5H)-Furanone, 4-(4-(methylsulfonyl)phenyl)-3-phenyl-
MFCD00935806
Vioxx
Ceoxx
MK-0966
4-[4-(Methylsulfonyl)phenyl]-3-phenyl
4-(4-(methylsulfonyl)phenyl)-3-phenylfuran-2(5H)-one
2(5H)-Furanone, 4-[4-(methylsulfonyl)phenyl]-3-phenyl-
2(5H)-Furanone,4-4-(methylsulfonyl)phenyl-3-phenyl
4-(4-methylsulfonylphenyl)-3-phenyl-2,5-dihydrofuran-2-one
Ceeoxx
4-(4-methanesulfonylphenyl)-3-phenyl-5H-furan-2-one

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
577.6±50.0 °C at 760 mmHg

[ Melting Point ]:
207°C

[ Molecular Formula ]:
C₁₇H₁₄O₄S

[ Molecular Weight ]:
314.356

[ Flash Point ]:
303.1±30.1 °C

[ Exact Mass ]:
314.061279

[ PSA ]:
68.82000

[ LogP ]:
1.34

[ Vapour Pressure ]:
0.0±1.6 mmHg at 25°C

[ Index of Refraction ]:
1.619

[ Storage condition ]:
Refrigerator

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
22

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
LU5135000

[ HS Code ]:
29309070

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Phenylacetic acid
2-Bromo-1-[4-(methylsulfonyl)phenyl]ethanone
3-(4-methylsulfanylphenyl)-4-phenyl-2H-furan-5-one
[2-(4-methylsulfonylphenyl)-2-oxoethyl] 2-phenylacetate
ethyl 2-bromoacetate
3-chloro-4-(4'-methylsulfonylphenyl)-5H-furan-2-one
Phenylboronic acid
Water
Triethylamine
2-(diethoxyphosphino)-2-phenylacetic acid

DownStream

5-Hydroxy Vioxx
2-(4-methylsulfonylphenyl)-3-phenylbut-2-ene-1,4-diol

Customs

[ HS Code ]: 2932209090

[ Summary ]:
2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles

Validation of cyclooxygenase-2 as a direct anti-inflammatory target of 4-O-methylhonokiol in zymosan-induced animal models.

Arch. Pharm. Res. 38 , 813-25, (2015)

4-O-methylhonokiol (MH) is known to inhibit inflammation by partially understood mechanisms. Here, the anti-inflammatory mechanisms of MH were examined using enzymatic, cellular, and animal assays. In...

Celecoxib increases lung cancer cell lysis by lymphokine-activated killer cells via upregulation of ICAM-1.

Oncotarget 6 , 39342-56, (2015)

The antitumorigenic mechanism of the selective cyclooxygenase-2 (COX-2) inhibitor celecoxib is still a matter of debate. Using lung cancer cell lines (A549, H460) and metastatic cells derived from a l...

A human ether-á-go-go-related (hERG) ion channel atomistic model generated by long supercomputer molecular dynamics simulations and its use in predicting drug cardiotoxicity

Toxicol. Lett. 230(3) , 382-92, (2014)

• Current hERG assays remain insensitive as predictors of clinical toxicity. • We have developed a state-of-art computational model of hERG blocking. • The method was validated using two biological as...

Rofecoxib-d5
5-HYDROXY ROFECOXIB
4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
2-(Cyclohexyloxy)-4-iodophenol
1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
(4-Methyl-tetrahydro-furan-2-yl)-methanol
N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
tert-Butyl-DL-alanine
1-(4-methoxyphenyl)-4-(4-((6-methyl-2-oxo-2H-pyran-4-yl)oxy)piperidine-1-carbonyl)pyrrolidin-2-one