478253-36-0
3-HO-BENZALDEHYDE (3,7-DIME-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
Name3-HO-BENZALDEHYDE (3,7-DIME-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
1Identification
【Name】
3-HO-BENZALDEHYDE (3,7-DIME-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE
【CAS】
【MDL】
MFCD00497713
【English Synonyms】
【Formula】
C14 H14 N6 O3
【MolWeight】
314.304
【Inchi】
InChI=1S/C14H14N6O3/c1-19-10-11(20(2)14(23)17-12(10)22)16-13(19)18-15-7-8-4-3-5-9(21)6-8/h3-7,21H,1-2H3,(H,16,18)(H,17,22,23)/b15-7+
【InChIKey】
InChIKey=TVPHKMOQOUDYNO-VIZOYTHASA-N
【SMILES】
Cn1c2c(=O)[nH]c(=O)n(c2nc1N/N=C/c3cccc(c3)O)C
【MOL File】
3-HO-BENZALDEHYDE (3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-HO-BENZALDEHYDE (3,7-DIME-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)HYDRAZONE.cml