27945-43-3
3-(3,5-DIMETHYL-4-HYDROXYPHENYL)-2-METHYL-4(3H)-QUINAZOLINONE
Name3-(3,5-DIMETHYL-4-HYDROXYPHENYL)-2-METHYL-4(3H)-QUINAZOLINONE
1Identification
【Name】
3-(3,5-DIMETHYL-4-HYDROXYPHENYL)-2-METHYL-4(3H)-QUINAZOLINONE
【CAS】
【MDL】
MFCD01686116
【English Synonyms】
【Formula】
C17 H16 N2 O2
【MolWeight】
280.325
【Inchi】
InChI=1S/C17H16N2O2/c1-10-8-13(9-11(2)16(10)20)19-12(3)18-15-7-5-4-6-14(15)17(19)21/h4-9,20H,1-3H3
【InChIKey】
InChIKey=JENZANUHKHDPCZ-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1O)C)n2c(nc3ccccc3c2=O)C
【MOL File】
3-(3,5-DIMETHYL-4-HY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(3,5-DIMETHYL-4-HYDROXYPHENYL)-2-METHYL-4(3H)-QUINAZOLINONE.cml