539-21-9
AMBAZONE
Name
AMBAZONE
Formula
C8 H11 N7 S
MolWeight
237.29
1Identification
【Name】
AMBAZONE
【CAS】
【MDL】
MFCD00866217
【English Synonyms】
【Formula】
C8 H11 N7 S
【MolWeight】
237.29
【Inchi】
InChI=1S/C8H11N7S/c9-7(10)14-12-5-1-3-6(4-2-5)13-15-8(11)16/h1-4H,(H4,9,10,14)(H3,11,15,16)/b12-5-,13-6-
【InChIKey】
InChIKey=MLMFUKWWZIZRHX-VFWKFLPVSA-N
【SMILES】
C1=CC(=NNC(=S)N)C=CC1=NNC(=N)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:7
XLogP3:-3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
AMBAZONE.cml
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