D-erythro-Hexonic acid, 6-S-2-benzothiazolyl-2,4-dideoxy-6-thio-, 1,1-dimethylethyl ester
한글명:D-erythro-Hexonic acid, 6-S-2-benzothiazolyl-2,4-dideoxy-6-thio-, 1,1-dimethylethyl ester
카스 번호1469771-46-7
상품명:D-erythro-Hexonic acid, 6-S-2-benzothiazolyl-2,4-dideoxy-6-thio-, 1,1-dimethylethyl ester
CBNumberCB29378568
분자식C17H23NO4S2
포뮬러 무게369.5
MOL 파일1469771-46-7.mol
화학적 성질
끓는 점 | 546.7±60.0 °C(Predicted) |
밀도 | 1.30±0.1 g/cm3(Predicted) |
산도 계수 (pKa) | 13.86±0.20(Predicted) |
InChI | InChI=1S/C17H23NO4S2/c1-17(2,3)22-15(21)9-11(19)8-12(20)10-23-16-18-13-6-4-5-7-14(13)24-16/h4-7,11-12,19-20H,8-10H2,1-3H3/t11-,12-/m0/s1 |
InChIKey | KWBZUYSMHIAPBU-RYUDHWBXSA-N |
SMILES | C(OC(C)(C)C)(=O)C[C@H](C[C@@H](CSC1=NC2=CC=CC=C2S1)O)O |