557056-07-2
1,4-PIPERAZINEDICARBOXYLIC ACID, 2-(HYDROXYMETHYL)-, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER
Name1,4-PIPERAZINEDICARBOXYLIC ACID, 2-(HYDROXYMETHYL)-, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER
1Identification
【Name】
1,4-PIPERAZINEDICARBOXYLIC ACID, 2-(HYDROXYMETHYL)-, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER
【CAS】
【MDL】
MFCD17676397
【English Synonyms】
【Formula】
C18 H26 N2 O5
【MolWeight】
350.412
【Inchi】
InChI=1S/C18H26N2O5/c1-18(2,3)25-17(23)20-10-9-19(11-15(20)12-21)16(22)24-13-14-7-5-4-6-8-14/h4-8,15,21H,9-13H2,1-3H3
【InChIKey】
InChIKey=OKWDDQLIGHSFEA-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCN(CC1CO)C(=O)OCc2ccccc2
【MOL File】
1,4-PIPERAZINEDICARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-PIPERAZINEDICARBOXYLIC ACID, 2-(HYDROXYMETHYL)-, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER.cml