62382-85-8
5-[(4-CHLOROPHENOXY)METHYL]-1,3,4-OXADIAZOLE-2-THIOL
Name5-[(4-CHLOROPHENOXY)METHYL]-1,3,4-OXADIAZOLE-2-THIOL
1Identification
【Name】
5-[(4-CHLOROPHENOXY)METHYL]-1,3,4-OXADIAZOLE-2-THIOL
【CAS】
【MDL】
MFCD02065085
【English Synonyms】
【Formula】
C9 H7 Cl N2 O2 S
【MolWeight】
242.685
【Inchi】
InChI=1S/C9H7ClN2O2S/c10-6-1-3-7(4-2-6)13-5-8-11-12-9(15)14-8/h1-4H,5H2,(H,12,15)
【InChIKey】
InChIKey=PDXDDOYYKNFNDC-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1OCc2nnc(o2)S)Cl
【MOL File】
5-[(4-CHLOROPHENOXY)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-[(4-CHLOROPHENOXY)METHYL]-1,3,4-OXADIAZOLE-2-THIOL.cml