Molecular Structure:
CCD No.:CCD00011988
GRANULAR BLUE
CAS No.:
71431-29-3
Formula:C24 H22 N4 O3 . 2 Cl H
MolWeight:487.385
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| Product Name： | GRANULAR BLUE |
| CAS： | 71431-29-3 |
| English Synonyms： | GRANULAR BLUE |
| MDL Number.： | MFCD00012680 |
| H bond acceptor： | 7 |
| H bond donor： | 4 |
| Smile： | c1cc(ccc1c2cc3ccc(cc3[nH]2)C(=O)N)OCCOc4ccc(cc4)C(=N)N.Cl.Cl |
| InChi： | InChI=1S/C24H22N4O3.2ClH/c25-23(26)16-5-9-20(10-6-16)31-12-11-30-19-7-3-15(4-8-19)21-13-17-1-2-18(24(27)29)14-22(17)28-21;;/h1-10,13-14,28H,11-12H2,(H3,25,26)(H2,27,29);2*1H |
| InChiKey： | InChIKey=LSFMDPMWJFFWOD-UHFFFAOYSA-N |
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