1019009-68-7
ETHYL 5-AMINO-1-(2-BROMOPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
NameETHYL 5-AMINO-1-(2-BROMOPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
1Identification
【Name】
ETHYL 5-AMINO-1-(2-BROMOPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD06637280
【English Synonyms】
【Formula】
C12 H12 Br N3 O2
【MolWeight】
310.15
【Inchi】
InChI=1S/C12H12BrN3O2/c1-2-18-12(17)8-7-15-16(11(8)14)10-6-4-3-5-9(10)13/h3-7H,2,14H2,1H3
【InChIKey】
InChIKey=VHRXOCZHFUSLBV-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cnn(c1N)c2ccccc2Br
【MOL File】
ETHYL 5-AMINO-1-(2-B….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-AMINO-1-(2-BROMOPHENYL)-1H-PYRAZOLE-4-CARBOXYLATE.cml