164926-74-3
1,2,5-OXADIAZOLE-3-CARBOXYLIC ACID,4-AMINO-,ETHYL ESTER,2-OXIDE
Name1,2,5-OXADIAZOLE-3-CARBOXYLIC ACID,4-AMINO-,ETHYL ESTER,2-OXIDE
1Identification
【Name】
1,2,5-OXADIAZOLE-3-CARBOXYLIC ACID,4-AMINO-,ETHYL ESTER,2-OXIDE
【CAS】
【MDL】
MFCD03756662
【English Synonyms】
【Formula】
C5 H7 N3 O4
【MolWeight】
173.127
【Inchi】
InChI=1S/C5H7N3O4/c1-2-11-5(9)3-4(6)7-12-8(3)10/h2H2,1H3,(H2,6,7)
【InChIKey】
InChIKey=CWFBZYDCTISVCF-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(no[n+]1[O-])N
【MOL File】
1,2,5-OXADIAZOLE-3-C….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,5-OXADIAZOLE-3-CARBOXYLIC ACID,4-AMINO-,ETHYL ESTER,2-OXIDE.cml