5233-42-1

Name 5-Chloro Hydrochlorothiazide
CAS 5233-42-1
Molecular Formula C7H7Cl2N3O4S2
MDL Number MFCD18379277
Molecular Weight 332.18
MOL File 5233-42-1.mol
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Chemical Properties

Melting point  293-295°C
Boiling point  601.9±65.0 °C(Predicted)
density  1.769±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly), Acetonitrile (Heated)
form  Solid
pka 8.21±0.20(Predicted)
color  White to Off-White
Major Application pharmaceutical small molecule
InChI 1S/C7H7Cl2N3O4S2/c8-5-3(17(10,13)14)1-4-7(6(5)9)11-2-12-18(4,15)16/h1,11-12H,2H2,(H2,10,13,14)
InChIKey BSNKBIJVLZUERH-UHFFFAOYSA-N
SMILES [S]1(=O)(=O)NCNc2c1cc(c(c2Cl)Cl)[S](=O)(=O)N

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
WGK Germany  WGK 3
HS Code  2935909099
Storage Class 11 - Combustible Solids
Hazard Classifications Carc. 2

Hazard Information

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