845675-32-3
5-HYDROXY-1,4-DIMETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
Name5-HYDROXY-1,4-DIMETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
1Identification
【Name】
5-HYDROXY-1,4-DIMETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD16547345
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C6 H8 N2 O3
【pro_molWeight】
156.14
【Inchi】
InChI=1S/C6H8N2O3/c1-3-4(6(10)11)7-8(2)5(3)9/h9H,1-2H3,(H,10,11)
【InChIKey】
InChIKey=VMJXAWWMAAWUGA-UHFFFAOYSA-N
【SMILES】
Cc1c(nn(c1O)C)C(=O)O
【MOL File】
5-HYDROXY-1,4-DIMETH….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-HYDROXY-1,4-DIMETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID.cml