7035-82-7
ETHYL 5-METHYL-3-(4-NITROPHENYL)ISOXAZOLE-4-CARBOXYLATE
NameETHYL 5-METHYL-3-(4-NITROPHENYL)ISOXAZOLE-4-CARBOXYLATE
1Identification
【Name】
ETHYL 5-METHYL-3-(4-NITROPHENYL)ISOXAZOLE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD11977020
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H12 N2 O5
【pro_molWeight】
276.247
【Inchi】
InChI=1S/C13H12N2O5/c1-3-19-13(16)11-8(2)20-14-12(11)9-4-6-10(7-5-9)15(17)18/h4-7H,3H2,1-2H3
【InChIKey】
InChIKey=RVLHUCKJURWJIX-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(onc1c2ccc(cc2)[N+](=O)[O-])C
【MOL File】
ETHYL 5-METHYL-3-(4-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:7
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
ETHYL 5-METHYL-3-(4-NITROPHENYL)ISOXAZOLE-4-CARBOXYLATE.cml