basic_info |
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| Product_Name: | 4-[(([4-(2-METHYLPHENOXY)PHENYL]SULFONYL)AMINO)METHYL]BENZOIC ACID |
| CAS: | 885268-78-0 |
| EnglishSynonyms: | 4-[(([4-(2-METHYLPHENOXY)PHENYL]SULFONYL)AMINO)METHYL]BENZOIC ACID ; BENZOIC ACID, 4-[[[[4-(2-METHYLPHENOXY)PHENYL]SULFONYL]AMINO]METHYL]- ; 4-[(4-O-TOLYLOXY-BENZENESULFONYLAMINO)-METHYL]-BENZOIC ACID |
| pro_mdlNumber: | MFCD06409346 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | Cc1ccccc1Oc2ccc(cc2)S(=O)(=O)NCc3ccc(cc3)C(=O)O |
| InChi: | InChI=1S/C21H19NO5S/c1-15-4-2-3-5-20(15)27-18-10-12-19(13-11-18)28(25,26)22-14-16-6-8-17(9-7-16)21(23)24/h2-13,22H,14H2,1H3,(H,23,24) |
| InChiKey: | InChIKey=RAJRZONWHZRZEN-UHFFFAOYSA-N |
property |
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| MeltingPoint: | 198-202 DEG C |
| Comments: | HAZARD: R 36/37/38 HAZARD: S 26-37-60 UNSPSC: 12000000 |
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