392314-89-5
5-ACETYL-4-(3-ETHENYL-2-HYDROXYPHENYL)-3,4-DIHYDRO-6-METHYL-2(1H)-PYRIMIDINONE
Name5-ACETYL-4-(3-ETHENYL-2-HYDROXYPHENYL)-3,4-DIHYDRO-6-METHYL-2(1H)-PYRIMIDINONE
1Identification
【Name】
5-ACETYL-4-(3-ETHENYL-2-HYDROXYPHENYL)-3,4-DIHYDRO-6-METHYL-2(1H)-PYRIMIDINONE
【CAS】
【MDL】
MFCD00228549
【English Synonyms】
【Formula】
C15 H16 N2 O3
【MolWeight】
272.302
【Inchi】
InChI=1S/C15H16N2O3/c1-4-10-6-5-7-11(14(10)19)13-12(9(3)18)8(2)16-15(20)17-13/h4-7,13,19H,1H2,2-3H3,(H2,16,17,20)
【InChIKey】
InChIKey=QIZPJWMZRHZZDL-UHFFFAOYSA-N
【SMILES】
CC1=C(C(NC(=O)N1)c2cccc(c2O)C=C)C(=O)C
【MOL File】
5-ACETYL-4-(3-ETHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-ACETYL-4-(3-ETHENYL-2-HYDROXYPHENYL)-3,4-DIHYDRO-6-METHYL-2(1H)-PYRIMIDINONE.cml