494211-79-9

中文名称 3-DEHYDROQUINIC ACID 钾盐

英文名称 3-Dehydroquinic acid potassium salt, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid potassium salt

CAS 494211-79-9

分子式 C7H9O6.K

分子量 228.24

MOL 文件 494211-79-9.mol

494211-79-9 结构式

基本信息物理化学性质安全数据

基本信息

中文别名

5-DEHYDROQUINIC ACID 钾盐
3-DEHYDROQUINIC ACID 钾盐
(1R,3R,4S)-1,3,4-TRIHYDROXY-5-OXOCYCLOHEXANECARBOXYLIC ACID 钾盐

英文别名

5-Dehydroquinic acid potassium salt
3-Dehydroquinic acid potassium salt
3-Dehydroquinic acid potassium salt >=97.0% (TLC)
3-Dehydroquinic acid potassium salt, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid potassium salt

物理化学性质

储存条件2-8°C

形态powder

旋光度 (Optical Rotation)[α]/D -48.0±4.0°, c = 1.5 in H2O

InChI1S/C7H10O6.K/c8-3-1-7(13,6(11)12)2-4(9)5(3)10;/h3,5,8,10,13H,1-2H2,(H,11,12);/q;+1/p-1/t3-,5+,7-;/m1./s1

InChIKeyXOXNBNMEMILWBJ-HOMRGJANSA-M

SMILES[K+].O[C@@H]1C[C@@](O)(CC(=O)[C@H]1O)C([O-])=O

安全数据

危险品标志T

危险类别码25

安全说明45

危险品运输编号UN 2811 6.1 / PGIII

WGK Germany3

存储类别6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects

危险性类别Acute Tox. 3 Oral