915919-78-7
(5-METHYL-3-OXO-2,3-DIHYDRO-1H-PYRAZOL-4-YL)ACETIC ACID
Name
(5-METHYL-3-OXO-2,3-DIHYDRO-1H-PYRAZOL-4-YL)ACETIC ACID
Formula
C6 H8 N2 O3
MolWeight
156.14
1Identification
【Name】
(5-METHYL-3-OXO-2,3-DIHYDRO-1H-PYRAZOL-4-YL)ACETIC ACID
【CAS】
【MDL】
MFCD04170350
【English Synonyms】
【Formula】
C6 H8 N2 O3
【MolWeight】
156.14
【Inchi】
InChI=1S/C6H8N2O3/c1-3-4(2-5(9)10)6(11)8-7-3/h4H,2H2,1H3,(H,8,11)(H,9,10)
【InChIKey】
InChIKey=NFGYDEGDXANEHY-UHFFFAOYSA-N
【SMILES】
CC1=NNC(=O)C1CC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(5-METHYL-3-OXO-2,3-DIHYDRO-1H-PYRAZOL-4-YL)ACETIC ACID.cml
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