478253-24-6
4-ETHOXYBENZALDEHYDE (3,7-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
Name4-ETHOXYBENZALDEHYDE (3,7-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
1Identification
【Name】
4-ETHOXYBENZALDEHYDE (3,7-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
【CAS】
【MDL】
MFCD00497726
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H18 N6 O3
【pro_molWeight】
342.357
【Inchi】
InChI=1S/C16H18N6O3/c1-4-25-11-7-5-10(6-8-11)9-17-20-15-18-13-12(21(15)2)14(23)19-16(24)22(13)3/h5-9H,4H2,1-3H3,(H,18,20)(H,19,23,24)/b17-9+
【InChIKey】
InChIKey=SAMAVLHRYPCOQA-RQZCQDPDSA-N
【SMILES】
CCOc1ccc(cc1)/C=N/Nc2nc3c(n2C)c(=O)[nH]c(=O)n3C
【MOL File】
4-ETHOXYBENZALDEHYDE….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:9
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-ETHOXYBENZALDEHYDE (3,7-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE.cml