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Carbamic acid, N-[[1-[(5-bromo-2-chloro-4-pyrimidinyl)amino]cyclohexyl]methyl]-, 1,1-dimethylethyl ester
한글명:Carbamic acid, N-[[1-[(5-bromo-2-chloro-4-pyrimidinyl)amino]cyclohexyl]methyl]-, 1,1-dimethylethyl ester
카스 번호1374635-87-6
상품명:Carbamic acid, N-[[1-[(5-bromo-2-chloro-4-pyrimidinyl)amino]cyclohexyl]methyl]-, 1,1-dimethylethyl ester
CBNumberCB38140002
분자식C16H24BrClN4O2
포뮬러 무게419.74
MOL 파일1374635-87-6.mol
화학적 성질
끓는 점 | 555.8±35.0 °C(Predicted) |
밀도 | 1.397±0.06 g/cm3(Predicted) |
산도 계수 (pKa) | 12.81±0.46(Predicted) |
InChI | InChI=1S/C16H24BrClN4O2/c1-15(2,3)24-14(23)20-10-16(7-5-4-6-8-16)22-12-11(17)9-19-13(18)21-12/h9H,4-8,10H2,1-3H3,(H,20,23)(H,19,21,22) |
InChIKey | GPCHFSKUUKKXAN-UHFFFAOYSA-N |
SMILES | C(OC(C)(C)C)(=O)NCC1(NC2C(Br)=CN=C(Cl)N=2)CCCCC1 |