57031-66-0
1-METHYL-1H-[1,2,4]TRIAZOLE-3-CARBOXYLIC ACID METHYL ESTER
Name1-METHYL-1H-[1,2,4]TRIAZOLE-3-CARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
1-METHYL-1H-[1,2,4]TRIAZOLE-3-CARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD13191558
【English Synonyms】
【Formula】
C5 H7 N3 O2
【MolWeight】
141.129
【Inchi】
InChI=1S/C5H7N3O2/c1-8-3-6-4(7-8)5(9)10-2/h3H,1-2H3
【InChIKey】
InChIKey=NKPPQSVPTZHGMA-UHFFFAOYSA-N
【SMILES】
Cn1cnc(n1)C(=O)OC
【MOL File】
1-METHYL-1H-[1,2,4]T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-1H-[1,2,4]TRIAZOLE-3-CARBOXYLIC ACID METHYL ESTER.cml