Molecular Structure:
CCD No.:CCD00901380
WAY 213613
CAS No.:
868359-05-1
Formula:C16 H13 Br F2 N2 O4
MolWeight:415.189
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| Product Name： | WAY 213613 |
| CAS： | 868359-05-1 |
| English Synonyms： | N4-[4-(2-BROMO-4,5-DIFLUOROPHENOXY)PHENYL]-L-ASPARAGINE ; WAY 213613 |
| MDL Number.： | MFCD09971111 |
| H bond acceptor： | 6 |
| H bond donor： | 3 |
| Smile： | c1cc(ccc1NC(=O)C[C@@H](C(=O)O)N)Oc2cc(c(cc2Br)F)F |
| InChi： | InChI=1S/C16H13BrF2N2O4/c17-10-5-11(18)12(19)6-14(10)25-9-3-1-8(2-4-9)21-15(22)7-13(20)16(23)24/h1-6,13H,7,20H2,(H,21,22)(H,23,24)/t13-/m0/s1 |
| InChiKey： | InChIKey=BNYDDAAZMBUFRG-ZDUSSCGKSA-N |
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| Symbol： |
GHS07
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| Signal word： | Warning |
| Hazard statements： | H302 |
| hazard symbol： | Xn |
| Risk Code： | R:22 |
| WGK Germany： | 3 |
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