1-[[(4-Aminophenyl)methyl]sulfonyl]-pyrrolidine Structure

1-[[(4-Aminophenyl)methyl]sulfonyl]-pyrrolidine

Chemical Properties

Melting point 170-176°C
Boiling point 434.2±47.0 °C(Predicted)
Density  1.31
storage temp.  Refrigerator
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly, Sonicated)
pka 4.35±0.10(Predicted)
form  Solid
color  Off-White to Pale Yellow
InChI InChI=1S/C11H16N2O2S/c12-11-5-3-10(4-6-11)9-16(14,15)13-7-1-2-8-13/h3-6H,1-2,7-9,12H2
InChIKey VNSKHALYBQZMFW-UHFFFAOYSA-N
SMILES C1(N)=CC=C(CS(N2CCCC2)(=O)=O)C=C1
CAS DataBase Reference 334981-10-1(CAS DataBase Reference)
FDA UNII 2EU666P9ND

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319
Precautionary statements P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HS Code  2921490090
NFPA 704:
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