76985-52-9

Name JKIJLCYOCQWMQL-UFLZEWODSA-N
CAS 76985-52-9
Molecular Formula C10H18BrN3O2S
MDL Number MFCD07391178
Molecular Weight 324.238
MOL File 76985-52-9.mol
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Chemical Properties

storage temp.  Store at -20°C
solubility  DMSO: 125 mg/mL (385.52 mM)
form  Solid
color  White to off-white
InChI InChI=1/C10H17N3O2S.BrH/c11-10-12-6-5-16-7(9(6)13-10)3-1-2-4-8(14)15;/h6-7,9H,1-5H2,(H,14,15)(H3,11,12,13);1H/t6-,7-,9-;/s3
InChIKey JKIJLCYOCQWMQL-ONZDYIGBNA-N
SMILES C(O)(=O)CCCC[C@H]1[C@@]2([H])N=C(N)N[C@@]2([H])CS1.[H]Br |&1:7,8,14,r|

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