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3-(디에틸아미노)-7-옥소-7H-[1]벤조피라노[3,2:3,4]피리노[1,2-a]벤지이미다졸-6-카보니트릴
한글명:3-(디에틸아미노)-7-옥소-7H-[1]벤조피라노[3,2:3,4]피리노[1,2-a]벤지이미다졸-6-카보니트릴
카스 번호52372-36-8
상품명:Solvent Red 196
CBNumberCB4511780
분자식C23H18N4O2
포뮬러 무게382.41
MOL 파일52372-36-8.mol
동의어(한글)
3-(디에틸아미노)-7-옥소-7H-[1]벤조피라노[3,2:3,4]피리노[1,2-a]벤지이미다졸-6-카보니트릴
화학적 성질
끓는 점 | 575.3±60.0 °C(Predicted) |
밀도 | 1.34±0.1 g/cm3(Predicted) |
산도 계수 (pKa) | 4.58±0.40(Predicted) |
InChI | InChI=1S/C23H18N4O2/c1-3-26(4-2)15-10-9-14-11-16-21(29-20(14)12-15)17(13-24)23(28)27-19-8-6-5-7-18(19)25-22(16)27/h5-12H,3-4H2,1-2H3 |
InChIKey | UTTFXJZCRVZYQF-UHFFFAOYSA-N |
SMILES | C12C3=CC4=CC=C(N(CC)CC)C=C4OC3=C(C#N)C(=O)N1C1=CC=CC=C1N=2 |
LogP | 3.6 at 25℃ |
CAS 데이터베이스 | 52372-36-8(CAS DataBase Reference) |
EPA | 7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo- (52372-36-8) |