221325-76-4
2,4-DIHYDRO-4,4-DIHYDROXY-2-(1-METHYLETHYL)-3H-PYRAZOL-3-ONE
Name
2,4-DIHYDRO-4,4-DIHYDROXY-2-(1-METHYLETHYL)-3H-PYRAZOL-3-ONE
Formula
C6 H10 N2 O3
MolWeight
158.156
1Identification
【Name】
2,4-DIHYDRO-4,4-DIHYDROXY-2-(1-METHYLETHYL)-3H-PYRAZOL-3-ONE
【CAS】
【MDL】
MFCD18818358
【English Synonyms】
【Formula】
C6 H10 N2 O3
【MolWeight】
158.156
【Inchi】
InChI=1S/C6H10N2O3/c1-4(2)8-5(9)6(10,11)3-7-8/h3-4,10-11H,1-2H3
【InChIKey】
InChIKey=BJCXWOONUYVJMR-UHFFFAOYSA-N
【SMILES】
CC(C)N1C(=O)C(C=N1)(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
2,4-DIHYDRO-4,4-DIHYDROXY-2-(1-METHYLETHYL)-3H-PYRAZOL-3-ONE.cml
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