89-27-0
1-(3-NITROPHENYL)-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLIC ACID
Name
1-(3-NITROPHENYL)-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLIC ACID
pro_formula
C10 H7 N3 O5
pro_molWeight
249.181
1Identification
【Name】
1-(3-NITROPHENYL)-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00044058
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C10 H7 N3 O5
【pro_molWeight】
249.181
【Inchi】
InChI=1S/C10H7N3O5/c14-9-5-8(10(15)16)11-12(9)6-2-1-3-7(4-6)13(17)18/h1-4H,5H2,(H,15,16)
【InChIKey】
InChIKey=KAUQEIRKYADRME-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)[N+](=O)[O-])N2C(=O)CC(=N2)C(=O)O
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:8
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(3-NITROPHENYL)-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLIC ACID.cml
quick_release
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