basic_info |
|
| Product_Name： | ERASTIN |
| CAS： | 571203-78-6 |
| EnglishSynonyms： | 2-[1-[4-[2-(4-CHLOROPHENOXY)ACETYL]-1-PIPERAZINYL]ETHYL]-3-(2-ETHOXYPHENYL)-4(3H)-QUINAZOLINONE ; 4(3H)-QUINAZOLINONE, 2-[1-[4-[2-(4-CHLOROPHENOXY)ACETYL]-1-PIPERAZINYL]ETHYL]-3-(2-ETHOXYPHENYL)- ; ERASTIN |
| pro_mdlNumber： | MFCD09837984 |
| pro_acceptors： | 8 |
| pro_donors： | 0 |
| pro_smile： | CCOc1ccccc1n2c(=O)c3ccccc3nc2C(C)N4CCN(CC4)C(=O)COc5ccc(cc5)Cl |
| InChi： | InChI=1S/C30H31ClN4O4/c1-3-38-27-11-7-6-10-26(27)35-29(32-25-9-5-4-8-24(25)30(35)37)21(2)33-16-18-34(19-17-33)28(36)20-39-23-14-12-22(31)13-15-23/h4-15,21H,3,16-20H2,1-2H3 |
| InChiKey： | InChIKey=BKQFRNYHFIQEKN-UHFFFAOYSA-N |
property |
|
secure_info |
|
| secure_symbol： |
GHS06
|
| secure_signal_word： | Danger |
| secure_risk_stmt： | H301 |
| secure_cautionary_stmt： | P301 + P310 |
| secure_damage_code： | T |
| secure_risk_disclosure_stmt： | R:25 |
| secure_security_stmt： | S:45 |
| secure_wgk_germany： | 3 |
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