88544-94-9
1-(2,3-DIHYDROXYPROPYL)-4,6-DIMETHYLPYRIMIDIN-2(1H)-ONE
Name1-(2,3-DIHYDROXYPROPYL)-4,6-DIMETHYLPYRIMIDIN-2(1H)-ONE
1Identification
【Name】
1-(2,3-DIHYDROXYPROPYL)-4,6-DIMETHYLPYRIMIDIN-2(1H)-ONE
【CAS】
【MDL】
MFCD08691664
【English Synonyms】
【Formula】
C9 H14 N2 O3
【MolWeight】
198.221
【Inchi】
InChI=1S/C9H14N2O3/c1-6-3-7(2)11(9(14)10-6)4-8(13)5-12/h3,8,12-13H,4-5H2,1-2H3
【InChIKey】
InChIKey=JSVRIEDMQNZBHE-UHFFFAOYSA-N
【SMILES】
Cc1cc(n(c(=O)n1)CC(CO)O)C
【MOL File】
1-(2,3-DIHYDROXYPROP….mol
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
1-(2,3-DIHYDROXYPROPYL)-4,6-DIMETHYLPYRIMIDIN-2(1H)-ONE.cml