Molecular Structure:
CCD No.:CCD00180772
VALDECOXIB
CAS No.:
181695-72-7
Formula:C16 H14 N2 O3 S
MolWeight:314.364
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| Product Name： | VALDECOXIB |
| CAS： | 181695-72-7 |
| English Synonyms： | VALZ ; 4-(5-METHYL-3-PHENYL-4-ISOXAZOLYL)BENZENESULPHONAMIDE ; VALDICOXIB ; VALECOXIB ; VALUS ; 4-(5-METHYL-3-PHENYLISOXAZOL-4-YL)BENZENESULFONAMIDE ; 4-(5-METHYL-3-PHENYL-1,2-OXAZOL-4-YL)BENZENESULFONAMIDE ; VALDECOXIB ; VALDECOXIB/ ; 4-(5-METHYL-3-PHENYL-4-ISOXAZOLYL)BENZENESULFONAMIDE ; BEXTRA |
| MDL Number.： | MFCD00950568 |
| H bond acceptor： | 5 |
| H bond donor： | 1 |
| Smile： | Cc1c(c(no1)c2ccccc2)c3ccc(cc3)S(=O)(=O)N |
| InChi： | InChI=1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20) |
| InChiKey： | InChIKey=LNPDTQAFDNKSHK-UHFFFAOYSA-N |
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| Symbol： |
GHS08
GHS09
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| Signal word： | Warning |
| Hazard statements： | H361d-H373-H410 |
| Precautionary statements： | P273-P281-P501 |
| hazard symbol： | Xn,N |
| Risk Code： | R:63-48/22-51/53 |
| Safe Code： | S:36/37-61 |
| WGK Germany： | 3 |
Basic Information
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