19920-34-4
6-(5-METHYL-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-4-YL)-6-OXO-HEXANOIC ACID
Name6-(5-METHYL-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-4-YL)-6-OXO-HEXANOIC ACID
1Identification
【Name】
6-(5-METHYL-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-4-YL)-6-OXO-HEXANOIC ACID
【CAS】
【MDL】
MFCD01909723
【English Synonyms】
【Formula】
C10 H14 N2 O4
【MolWeight】
226.231
【Inchi】
InChI=1S/C10H14N2O4/c1-6-9(12-10(16)11-6)7(13)4-2-3-5-8(14)15/h2-5H2,1H3,(H,14,15)(H2,11,12,16)
【InChIKey】
InChIKey=QOKBZTDZIZMTMS-UHFFFAOYSA-N
【SMILES】
Cc1c([nH]c(=O)[nH]1)C(=O)CCCCC(=O)O
【MOL File】
6-(5-METHYL-2-OXO-2,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-(5-METHYL-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-4-YL)-6-OXO-HEXANOIC ACID.cml