219909-83-8

Name 3-[(2S,4S)-4-Mercaptopyrrolidine-2-carboxamido]benzoic acid hydrochloride
CAS 219909-83-8
EINECS(EC#) 606-882-9
Molecular Formula C12H15ClN2O3S
MDL Number MFCD10698849
Molecular Weight 302.78
MOL File 219909-83-8.mol
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Chemical Properties

Melting point  212 °C
storage temp.  Inert atmosphere,Room Temperature
solubility  DMSO (Slightly), Methanol (Slightly), Phosphoric Acid (Slightly), Water (Slightly)
form  Solid
color  White to Off-White
InChI InChI=1/C12H14N2O3S.ClH/c15-11(10-5-9(18)6-13-10)14-8-3-1-2-7(4-8)12(16)17;/h1-4,9-10,13,18H,5-6H2,(H,14,15)(H,16,17);1H/t9-,10-;/s3
InChIKey DDRIIBZWSJDJQQ-GQCGHMMXNA-N
SMILES C(O)(=O)C1=CC=CC(NC([C@@H]2C[C@H](S)CN2)=O)=C1.Cl |&1:10,12,r|
CAS DataBase Reference 219909-83-8(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

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