中文别名 | MRS1845(cas:544478-19-5) |
英文别名 | MRS1845,544478-19-5 |
CAS号 | 544478-19-5 |
SMILES | O=C(C1=C(C)N(CC#C)C(C)=C(C(OC)=O)C1C2=CC=CC([N+]([O-])=O)=C2)OCC |
Inchi | InChI=1S/C21H22N2O6/c1-6-11-22-13(3)17(20(24)28-5)19(18(14(22)4)21(25)29-7-2)15-9-8-10-16(12-15)23(26)27/h1,8-10,12,19H,7,11H2,2-5H3 |
InchiKey | BITHABUTZRAUGT-UHFFFAOYSA-N |
分子式 Formula | C21H22N2O6 |
分子量 Molecular Weight | 398.41 |
闪点 FP | 262.8±30.1 ℃ |
沸点 Boiling point | 511.0±50.0 ℃ at 760 mmHg |
Polarizability极化度 | 41.4±0.5 10-24cm3 |
密度 Density | 1.2±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±1.3 mmHg at 25℃ |
溶解度Solubility | 生物体外In Vitro:DMSO溶解度≥ 125 mg/mL(313.75 mM)H2O :< 0.1 mg/mL(insoluble)*"≥" means soluble可溶, but saturation unknown溶解度未知. |
性状 | Solid |
储藏条件 Storage conditions | 请根据产品建议的存储条件进行存储,Please store the product under the recommended condition sin the description. |