83592-08-9
BENZYL 3-(4-(N-BENZYLOXYCARBONXYL-6-AMINOCAPROYLOXY)PHENYL)PROPIONATE
NameBENZYL 3-(4-(N-BENZYLOXYCARBONXYL-6-AMINOCAPROYLOXY)PHENYL)PROPIONATE
1Identification
【Name】
BENZYL 3-(4-(N-BENZYLOXYCARBONXYL-6-AMINOCAPROYLOXY)PHENYL)PROPIONATE
【CAS】
【MDL】
MFCD09839992
【English Synonyms】
【Formula】
C30 H33 N O6
【MolWeight】
503.592
【Inchi】
InChI=1S/C30H33NO6/c32-28(35-22-25-10-4-1-5-11-25)20-17-24-15-18-27(19-16-24)37-29(33)14-8-3-9-21-31-30(34)36-23-26-12-6-2-7-13-26/h1-2,4-7,10-13,15-16,18-19H,3,8-9,14,17,20-23H2,(H,31,34)
【InChIKey】
InChIKey=XUXLRAADZAUJLF-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COC(=O)CCc2ccc(cc2)OC(=O)CCCCCNC(=O)OCc3ccccc3
【MOL File】
BENZYL 3-(4-(N-BENZY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZYL 3-(4-(N-BENZYLOXYCARBONXYL-6-AMINOCAPROYLOXY)PHENYL)PROPIONATE.cml