中文别名 | 7-(2-氯乙基)茶碱(MSDS,5878-61-5结构式,分子量,溶解度) |
英文别名 | 7-(2-Chloroethyl)theophylline();7-(2-Chloroethyl)theophylline |
CAS号 | 5878-61-5 |
SMILES | Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCl |
Inchi | InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3 |
InchiKey | QCIARNIKNKKHFH-UHFFFAOYSA-N |
分子式 Formula | C9H11ClN4O2 |
分子量 Molecular Weight | 242.66 |
闪点 FP | 231.9±30.4 ℃ |
沸点 Boiling point | 459.8±51.0 ℃ at 760 mmHg |
Polarizability极化度 | 23.7±0.5 10-24cm3 |
密度 Density | 1.5±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±1.1 mmHg at 25℃ |
储藏条件 Storage conditions | Store at 4℃,-4℃下存储更优 |