402603-90-1
PROPYL 6-METHYL-4-(3-METHYLPHENYL)-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE
NamePROPYL 6-METHYL-4-(3-METHYLPHENYL)-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE
1Identification
【Name】
PROPYL 6-METHYL-4-(3-METHYLPHENYL)-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE
【CAS】
【MDL】
MFCD16877003
【English Synonyms】
【Formula】
C16 H20 N2 O3
【MolWeight】
288.345
【Inchi】
InChI=1S/C16H20N2O3/c1-4-8-21-15(19)13-11(3)17-16(20)18-14(13)12-7-5-6-10(2)9-12/h5-7,9,14H,4,8H2,1-3H3,(H2,17,18,20)
【InChIKey】
InChIKey=SECKCGBVSGCACJ-UHFFFAOYSA-N
【SMILES】
CCCOC(=O)C1=C(NC(=O)NC1c2cccc(c2)C)C
【MOL File】
PROPYL 6-METHYL-4-(3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PROPYL 6-METHYL-4-(3-METHYLPHENYL)-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE.cml