18667-26-0
2,6-HEPTANEDIONE, BIS(4-METHYL-3-THIOSEMICARBAZONE)
Name2,6-HEPTANEDIONE, BIS(4-METHYL-3-THIOSEMICARBAZONE)
1Identification
【Name】
2,6-HEPTANEDIONE, BIS(4-METHYL-3-THIOSEMICARBAZONE)
【CAS】
【MDL】
MFCD01723815
【English Synonyms】
【Formula】
C11 H22 N6 S2
【MolWeight】
302.469
【Inchi】
InChI=1S/C11H22N6S2/c1-8(14-16-10(18)12-3)6-5-7-9(2)15-17-11(19)13-4/h5-7H2,1-4H3,(H2,12,16,18)(H2,13,17,19)/b14-8+,15-9+
【InChIKey】
InChIKey=IBBJVLJKTNANGK-VOMDNODZSA-N
【SMILES】
C/C(=N\NC(=S)NC)/CCC/C(=N/NC(=S)NC)/C
【MOL File】
2,6-HEPTANEDIONE, BI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-HEPTANEDIONE, BIS(4-METHYL-3-THIOSEMICARBAZONE).cml