1228779-96-1

Name 3-nitro-4-((tetrahydro-2H-pyran-4-yl)MethylaMino)benzenesulfonaMide
CAS 1228779-96-1
EINECS(EC#) 1592732-453-0
Molecular Formula C12H17N3O5S
MDL Number MFCD28142285
Molecular Weight 315.345
MOL File 1228779-96-1.mol

Chemical Properties

Melting point  188 - 191°C
Boiling point  542.0±60.0 °C(Predicted)
density  1.412±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 9.58±0.60(Predicted)
color  Yellow to Dark Yellow
InChI InChI=1S/C12H17N3O5S/c13-21(18,19)10-1-2-11(12(7-10)15(16)17)14-8-9-3-5-20-6-4-9/h1-2,7,9,14H,3-6,8H2,(H2,13,18,19)
InChIKey HNQRHNYBVWICKB-UHFFFAOYSA-N
SMILES C1(S(N)(=O)=O)=CC=C(NCC2CCOCC2)C([N+]([O-])=O)=C1
CAS DataBase Reference 1228779-96-1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
REACH Registrations Active
HS Code  2932990090

Hazard Information

Supplier