| Chemical & Physical Properties | |
|---|---|
| CAS Number | 66455-26-3 |
| Catalog No. | 2A-9046429 |
| Chinese Name | 复合肥 NPK |
| Molecular Formula | C90H101N27O7S |
| Molecular Weight | 1705.0 |
| Purity | 98.00 |
| PubChem ID | 441067447 |
| SMILES | CCc1ccnc(NC(=O)c2ccc(-c3nn(C4CCN(C(=O)C=CCN(C)C5CC5)C4)c4ncnc(N)c34)cc2)c1.COc1cc(-c2nn(C3CCN(C(=O)C=CCN(C)C4CC4)C3)c3ncnc(N)c23)ccc1C(=O)Nc1cc(C)ccn1.Cc1cnc(NC(=O)c2ccc(-c3nn(C4CCN(C(=O)C=CCN(C)C5CC5)C4)c4ncnc(N)c34)cc2)s1 |
| InChI | InChI=1S/C31H35N9O3.C31H35N9O2.C28H31N9O2S/c1-19-10-12-33-25(15-19)36-31(42)23-9-6-20(16-24(23)43-3)28-27-29(32)34-18-35-30(27)40(37-28)22-11-14-39(17-22)26(41)5-4-13-38(2)21-7-8-21;1-3-20-12-14-33-25(17-20)36-31(42)22-8-6-21(7-9-22)28-27-29(32)34-19-35-30(27)40(37-28)24-13-16-39(18-24)26(41)5-4-15-38(2)23-10-11-23;1-17-14-30-28(40-17)33-27(39)19-7-5-18(6-8-19)24-23-25(29)31-16-32-26(23)37(34-24)21-11-13-36(15-21)22(38)4-3-12-35(2)20-9-10-20/h4-6,9-10,12,15-16,18,21-22H,7-8,11,13-14,17H2,1-3H3,(H2,32,34,35)(H,33,36,42);4-9,12,14,17,19,23-24H,3,10-11,13,15-16,18H2,1-2H3,(H2,32,34,35)(H,33,36,42);3-8,14,16,20-21H,9-13,15H2,1-2H3,(H2,29,31,32)(H,30,33,39) |
| InChI Key | ZJEDKXXULJUKFQ-UHFFFAOYSA-N |
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