1250994-55-8
PYRROLO[3,2-B]PYRROLE-1,6A-DICARBOXYLIC ACID, HEXAHYDRO-, 1-(1,1-DIMETHYLETHYL) 6A-ETHYL ESTER
NamePYRROLO[3,2-B]PYRROLE-1,6A-DICARBOXYLIC ACID, HEXAHYDRO-, 1-(1,1-DIMETHYLETHYL) 6A-ETHYL ESTER
1Identification
【Name】
PYRROLO[3,2-B]PYRROLE-1,6A-DICARBOXYLIC ACID, HEXAHYDRO-, 1-(1,1-DIMETHYLETHYL) 6A-ETHYL ESTER
【CAS】
【MDL】
MFCD17016469
【English Synonyms】
【Formula】
C14 H24 N2 O4
【MolWeight】
284.354
【Inchi】
InChI=1S/C14H24N2O4/c1-5-19-11(17)14-7-8-15-10(14)6-9-16(14)12(18)20-13(2,3)4/h10,15H,5-9H2,1-4H3
【InChIKey】
InChIKey=QLPXWVCIJGAGHW-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C12CCNC1CCN2C(=O)OC(C)(C)C
【MOL File】
PYRROLO[3,2-B]PYRROL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PYRROLO[3,2-B]PYRROLE-1,6A-DICARBOXYLIC ACID, HEXAHYDRO-, 1-(1,1-DIMETHYLETHYL) 6A-ETHYL ESTER.cml