Chemical Properties of Chlorothiazide (CAS 58-94-6)

Chlorothiazide

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13)
InChI Key
JBMKAUGHUNFTOL-UHFFFAOYSA-N
Formula
C7H6ClN3O4S2
SMILES
NS(=O)(=O)c1cc2c(cc1Cl)N=CNS2(=O)=O
Molecular Weight1
295.72
CAS
58-94-6
Other Names
  • 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-, 1,1-dioxide
  • 6-Chloro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide
  • 6-Chloro-7-sulfamoyl-2H-1,2,4-benzothiadiazine 1,1-dioxide
  • Alurene
  • Chloriazid
  • Chlorosal
  • Chlorothiazid
  • Chlorthiazide
  • Chlortiazid
  • Chlorurit
  • Chlotride
  • Chlrosal
  • Clotride
  • Diuresal
  • Diuril
  • Diuril Boluses
  • Diurilix
  • Diurite
  • Diutrid
  • Flumen
  • Minzil
  • NSC 25693
  • Neo-Dema
  • SK-chlorothiazide
  • Salisan
  • Salunil
  • Saluretil
  • Saluric
  • Thiazide
  • Urinex
  • Warduzide
  • Yadalan
Sources

Physical Properties

Property Value Unit Source
Δf -493.43 kJ/mol Joback Calculated Property
Δfgas -617.41 kJ/mol Joback Calculated Property
Δfus 49.35 kJ/mol Joback Calculated Property
Δvap 100.38 kJ/mol Joback Calculated Property
logPoct/wat -0.06 Crippen Calculated Property
Pc 9122.35 kPa Joback Calculated Property
Tboil 702.84 K Joback Calculated Property
Tc 947.15 K Joback Calculated Property
Tfus 667.97 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 413.67 J/mol×K 702.84 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-Cl 1
-S- (ring) 1
=CH- (ring) 3
>NH (ring) 1
-NH2 1
=C< (ring) 4
-S- 1
-N= (ring) 1
=O 4

Similar Compounds

4-Amino-2-chloro-5(methylsulfamyl)benzenesulfonamide. 6-Chloro-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide. 1,3-Disulfonamide, 4-amino-6-chlorobenzene-. 6-Chloro-2-methyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide. 6-Chloro-7-sulfamyl-3(4h)-oxo-1,2,4-benzothiadiazine-1,1-dioxide. 6-Chloro-2-methyl-7-methylsulfamyl-benzothiatriazine-1,1-dioxide. 5,6-Dichloro-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide. 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-N,N,2,4-tetramethyl-, 1,1-dioxide. Trichlormethiazide. Cyclothiazide. POLYTHIAZIDE. Dichlorphenamide tetra-methyl derivative. 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 3,4-dihydro-N,N,2,4-tetramethyl-6-(trifluoromethyl)-, 1,1-dioxide. 3-Bromomethyl-6-bromo-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide. 4-Chloro-N-(2-methyl-4-nitrophenyl)-benzenesulfonamide, N-heptafluorobutyryl-.

Find more compounds similar to Chlorothiazide.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.