53681-51-9
6-AMINO-1-BENZYL-3-METHYL-1H-PYRIMIDINE-2,4-DIONE
Name
6-AMINO-1-BENZYL-3-METHYL-1H-PYRIMIDINE-2,4-DIONE
Formula
C12 H13 N3 O2
MolWeight
231.254
1Identification
【Name】
6-AMINO-1-BENZYL-3-METHYL-1H-PYRIMIDINE-2,4-DIONE
【CAS】
【MDL】
MFCD03480188
【English Synonyms】
【Formula】
C12 H13 N3 O2
【MolWeight】
231.254
【Inchi】
InChI=1S/C12H13N3O2/c1-14-11(16)7-10(13)15(12(14)17)8-9-5-3-2-4-6-9/h2-7H,8,13H2,1H3
【InChIKey】
InChIKey=KXLNUNZSPLVKFM-UHFFFAOYSA-N
【SMILES】
Cn1c(=O)cc(n(c1=O)Cc2ccccc2)N
【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
6-AMINO-1-BENZYL-3-METHYL-1H-PYRIMIDINE-2,4-DIONE.cml
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