1,4-BENZODIOXAN-2-CARBOXYLIC ACID, 3-PHENYL-, 2-(2-(DIETHYLAMINO)ETHOX Y)ETHYL ESTER, CITRATE, (E)-

100447-55-0

MFCD01659452

C23 H29 N O5 . C6 H8 O7

591.606

InChI=1S/C23H29NO5.C6H8O7/c1-3-24(4-2)14-15-26-16-17-27-23(25)22-21(18-10-6-5-7-11-18)28-19-12-8-9-13-20(19)29-22;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-13,21-22H,3-4,14-17H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t21-,22+;/m1./s1

InChIKey=HMXGHFLWBHEPPJ-NSLUPJTDSA-N

CCN(CC)CCOCCOC(=O)[C@@H]1[C@H](Oc2ccccc2O1)c3ccccc3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

H bond donor:0

H bond acceptor:6

XLogP3:3.0

Bulk/Fine:F