76823-97-7

Name N-DesaMinosulfonyl-N-cyano FaMotidine
CAS 76823-97-7
Molecular Formula C9H13N7S2
MDL Number MFCD30729577
Molecular Weight 283.38
MOL File 76823-97-7.mol
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Chemical Properties

Boiling point  461.2±55.0 °C(Predicted)
density  1.58±0.1 g/cm3(Predicted)
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 8.52±0.70(Predicted)
color  White to Off-White
Stability: Hygroscopic, Moisture Sensitive
InChI InChI=1S/C9H13N7S2/c10-5-14-7(11)1-2-17-3-6-4-18-9(15-6)16-8(12)13/h4H,1-3H2,(H2,11,14)(H4,12,13,15,16)
InChIKey DFHYHFAHYAJKDU-UHFFFAOYSA-N
SMILES C(NC#N)(=N)CCSCC1=CSC(NC(N)=N)=N1

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