5404-87-5
(2Z,6Z)-2,6-DIHYDRAZONO-2,3,6,9-TETRAHYDRO-1H-PURINE
Name(2Z,6Z)-2,6-DIHYDRAZONO-2,3,6,9-TETRAHYDRO-1H-PURINE
1Identification
【Name】
(2Z,6Z)-2,6-DIHYDRAZONO-2,3,6,9-TETRAHYDRO-1H-PURINE
【CAS】
【MDL】
MFCD22207931
【English Synonyms】
【Formula】
C5 H8 N8
【MolWeight】
180.174
【Inchi】
InChI=1S/C5H8N8/c6-12-4-2-3(9-1-8-2)10-5(11-4)13-7/h1H,6-7H2,(H3,8,9,10,11,12,13)
【InChIKey】
InChIKey=VRLDULPVKJSIRN-UHFFFAOYSA-N
【SMILES】
c1[nH]c2c(n1)/c(=N\N)/[nH]/c(=N/N)/[nH]2
【MOL File】
(2Z,6Z)-2,6-DIHYDRAZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:8
XLogP3:-5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2Z,6Z)-2,6-DIHYDRAZONO-2,3,6,9-TETRAHYDRO-1H-PURINE.cml