852389-17-4
[5-(4-FLUOROPHENYL)-2-OXO-1,3,4-OXADIAZOL-3(2H)-YL]ACETIC ACID
Name[5-(4-FLUOROPHENYL)-2-OXO-1,3,4-OXADIAZOL-3(2H)-YL]ACETIC ACID
1Identification
【Name】
[5-(4-FLUOROPHENYL)-2-OXO-1,3,4-OXADIAZOL-3(2H)-YL]ACETIC ACID
【CAS】
【MDL】
MFCD06655503
【English Synonyms】
【Formula】
C10 H7 F N2 O4
【MolWeight】
238.173
【Inchi】
InChI=1S/C10H7FN2O4/c11-7-3-1-6(2-4-7)9-12-13(5-8(14)15)10(16)17-9/h1-4H,5H2,(H,14,15)
【InChIKey】
InChIKey=MWVSPYYEJYTGJS-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1c2nn(c(=O)o2)CC(=O)O)F
【MOL File】
[5-(4-FLUOROPHENYL)-….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
[5-(4-FLUOROPHENYL)-2-OXO-1,3,4-OXADIAZOL-3(2H)-YL]ACETIC ACID.cml