956700-84-8
DIETHYL 1,3-DIPHENYL-1,2,3,6-TETRAHYDROPYRIMIDINE-4,5-DICARBOXYLATE
NameDIETHYL 1,3-DIPHENYL-1,2,3,6-TETRAHYDROPYRIMIDINE-4,5-DICARBOXYLATE
1Identification
【Name】
DIETHYL 1,3-DIPHENYL-1,2,3,6-TETRAHYDROPYRIMIDINE-4,5-DICARBOXYLATE
【CAS】
【MDL】
MFCD11707069
【English Synonyms】
【Formula】
C22 H24 N2 O4
【MolWeight】
380.442
【Inchi】
InChI=1S/C22H24N2O4/c1-3-27-21(25)19-15-23(17-11-7-5-8-12-17)16-24(18-13-9-6-10-14-18)20(19)22(26)28-4-2/h5-14H,3-4,15-16H2,1-2H3
【InChIKey】
InChIKey=NROHKQXGAWAUKP-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(N(CN(C1)c2ccccc2)c3ccccc3)C(=O)OCC
【MOL File】
DIETHYL 1,3-DIPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIETHYL 1,3-DIPHENYL-1,2,3,6-TETRAHYDROPYRIMIDINE-4,5-DICARBOXYLATE.cml