75810-49-0
2-(3,4-DIMETHOXY-PHENYL)-1-METHYL-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
Name2-(3,4-DIMETHOXY-PHENYL)-1-METHYL-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
2-(3,4-DIMETHOXY-PHENYL)-1-METHYL-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00030540
【English Synonyms】
【Formula】
C14 H17 N O5
【MolWeight】
279.29
【Inchi】
InChI=1S/C14H17NO5/c1-15-12(16)7-9(14(17)18)13(15)8-4-5-10(19-2)11(6-8)20-3/h4-6,9,13H,7H2,1-3H3,(H,17,18)
【InChIKey】
InChIKey=IGCUAQHQLRVAAG-UHFFFAOYSA-N
【SMILES】
CN1C(C(CC1=O)C(=O)O)c2ccc(c(c2)OC)OC
【MOL File】
2-(3,4-DIMETHOXY-PHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(3,4-DIMETHOXY-PHENYL)-1-METHYL-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID.cml