739345-95-0
4-(1H-IMIDAZOL-4-YL)-1,3-DIMETHYL-PYRROLIDIN-2-ONE
Name4-(1H-IMIDAZOL-4-YL)-1,3-DIMETHYL-PYRROLIDIN-2-ONE
1Identification
【Name】
4-(1H-IMIDAZOL-4-YL)-1,3-DIMETHYL-PYRROLIDIN-2-ONE
【CAS】
【MDL】
MFCD14583855
【English Synonyms】
【Formula】
C9 H13 N3 O
【MolWeight】
179.222
【Inchi】
InChI=1S/C9H13N3O/c1-6-7(4-12(2)9(6)13)8-3-10-5-11-8/h3,5-7H,4H2,1-2H3,(H,10,11)
【InChIKey】
InChIKey=PDBQONAMLMAYOR-UHFFFAOYSA-N
【SMILES】
CC1C(CN(C1=O)C)c2c[nH]cn2
【MOL File】
4-(1H-IMIDAZOL-4-YL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(1H-IMIDAZOL-4-YL)-1,3-DIMETHYL-PYRROLIDIN-2-ONE.cml