83520-31-4
2(1H)-PYRAZINONE, 3,6-DIHYDRO-1-HYDROXY-6,6-DIMETHYL-, 4-OXIDE
Name
2(1H)-PYRAZINONE, 3,6-DIHYDRO-1-HYDROXY-6,6-DIMETHYL-, 4-OXIDE
Formula
C6 H10 N2 O3
MolWeight
158.156
1Identification
【Name】
2(1H)-PYRAZINONE, 3,6-DIHYDRO-1-HYDROXY-6,6-DIMETHYL-, 4-OXIDE
【CAS】
【MDL】
MFCD18833230
【English Synonyms】
【Formula】
C6 H10 N2 O3
【MolWeight】
158.156
【Inchi】
InChI=1S/C6H10N2O3/c1-6(2)4-7(10)3-5(9)8(6)11/h4,11H,3H2,1-2H3
【InChIKey】
InChIKey=IKWXYQGWICFHMN-UHFFFAOYSA-N
【SMILES】
CC1(C=[N+](CC(=O)N1O)[O-])C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2(1H)-PYRAZINONE, 3,6-DIHYDRO-1-HYDROXY-6,6-DIMETHYL-, 4-OXIDE.cml
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