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HCTZ (Hydrochlorothiazide)

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Identification
Molecular formula
C7H8ClN3O4S2
CAS number
58-93-5
IUPAC name
3-isopropyl-2,2-dioxo-1H-2lambda6,1,3-benzothiadiazin-4-one
State
State

At room temperature, Hydrochlorothiazide is a solid.

Melting point (Celsius)
273.00
Melting point (Kelvin)
546.20
Boiling point (Celsius)
588.40
Boiling point (Kelvin)
861.50
General information
Molecular weight
297.74g/mol
Molar mass
297.7390g/mol
Density
1.6806g/cm3
Appearence

The compound appears as a white crystalline powder. It is odorless and is used primarily as a medication.

Comment on solubility

Solubility of 3-isopropyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one

The solubility of 3-isopropyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one (C7H8ClN3O4S2) exhibits some noteworthy characteristics, driven largely by its molecular structure and functional groups. Generally, solubility can be influenced by factors such as polarity, the presence of hydrogen bond donors or acceptors, and interactions with solvents. Here are key points to consider:

  • Polarity: The compound contains both polar and nonpolar regions, indicating variable solubility in different solvents.
  • Hydrogen Bonding: The presence of multiple functional groups, including those with potential hydrogen bond capabilities, may enhance solubility in polar solvents like water.
  • Solvent Compatibility: Expected to be more soluble in organic solvents due to its hydrophobic isopropyl group and potential interactions within nonpolar environments.
  • Environmental Factors: Temperature and pressure may also significantly impact solubility, often increasing it in more energetic environments.

In summary, while the solubility of this compound is influenced by its complex structure, it is anticipated to exhibit moderate solubility in specific solvents. As with many chemical compounds, understanding its solubility is crucial for applications in synthesis and formulation.

Interesting facts

Interesting Facts About 3-Isopropyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one

This intriguing compound, known as 3-isopropyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one, presents a fascinating array of characteristics that spark interest among chemists and researchers alike.

Key Features:

  • Diverse Functional Groups: The presence of both dioxo and thiadiazin groups contributes to its unique chemical reactivity and potential applications in medicinal chemistry.
  • Pharmaceutical Potential: Compounds of this class are often explored for use as therapeutic agents, due to their ability to interact with biological systems in potentially beneficial ways.
  • Synthetic Applications: Due to its complex structure, this compound serves as a valuable building block for synthesizing other more complex molecules, paving the way for innovations in drug design.
  • Environmental Impact: Understanding the degradation and behavior of such compounds in the environment is essential, especially when considering their long-term ecological effects.

As a noteworthy member of the benzothiadiazin family, this compound can be a topic of lively discussion:

“Exploring the unique architectures of compounds like this one can often lead to unexpected discoveries in both chemistry and biology.”

This niche area of research emphasizes the importance of structural diversity in organic compounds, opening doors to novel applications in pharmaceuticals, agrochemicals, and beyond.

In summary, 3-isopropyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one not only embodies a complex chemical structure but also reflects the broader themes of innovation and discovery in chemistry.

Synonyms
Bentazone
bentazon
25057-89-0
Basagran
Bendioxide
Leader
Basagran 480
Pentazone
Laddok
Pledge
Basagran-plus
1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-(1-methylethyl)-, 2,2-dioxide
Basagran M
Basagran KV
Bentazon [ANSI]
Caswell No. 509C
Bentazone [BSI:ISO]
BAS 351H
Bentazone [ISO]
BAS 3510H
BAS 3512H
BAS 3517H
BAS 3510
BAS 351-07H
CCRIS 6977
BAS 351-H
HSDB 3430
R4S7ZGZ9CT
EINECS 246-585-8
EPA Pesticide Chemical Code 275200
BRN 0530220
CHEBI:3018
3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide
DTXSID0023901
1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-isopropyl-, 2,2-dioxide
BENTAZON [MI]
BENTAZONE [HSDB]
3-Isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one-2,2-dioxide
3-Isopropyl-2,1,3-benzothiadiazinon-(4)-2,2-dioxid
3-(1-METHYLETHYL)-1H-2,1,3-BENZOTHIADIAZIN-4(3H)-ONE 2,2-DIOXIDE
3-Isopropyl-4H-2,1,3-benzothiadiazin-4-one 2,2-dioxide
DTXCID503901
3-Isopropyl-1H-benzo-2,1,3-thiadiazin-4-one 2,2-dioxide
1H-2,1,3-Benzothiadiazin-4(3H)-one-2,2-dioxide, 3-isopropyl-
3-Isopropyl-2,1,3-benzothiadiazinon-(4)-2,2-dioxid [German]
3-(1-Methylethyl)-(1H)-2,1,3-benzothiadiazin-4(3H)-one-2,2-dioxide
Bentazon (ANSI)
Bentazone 10 microg/mL in Acetonitrile
Bentazone 100 microg/mL in Acetonitrile
3-isopropyl-2,2-dioxo-1H-2$l^{6},1,3-benzothiadiazin-4-one
Graminon-plus
Adagio
3-(propan-2-yl)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide
3-isopropyl-1H-benzo[c][1,2,6]thiadiazin-4(3H)-one 2,2-dioxide
3-(propan-2-yl)-3,4-dihydro-1H-2lambda6,1,3-benzothiadiazine-2,2,4-trione
CAS-25057-89-0
UNII-R4S7ZGZ9CT
Basagranplus
Graminonplus
3-Isopropyl-2,1,3-benzothiadiazinon-(4)-2,2-dioxid (German)
3-isopropyl-2,2-dioxo-1H-2$l^(6),1,3-benzothiadiazin-4-one
Spectrum_001851
SpecPlus_000462
Spectrum2_001889
Spectrum3_000831
Spectrum4_000671
Spectrum5_001976
Oprea1_558180
Oprea1_729468
SCHEMBL53939
BSPBio_002381
KBioGR_001101
KBioSS_002368
SPECTRUM330039
DivK1c_006558
SPBio_001798
CHEMBL1567045
KBio1_001502
KBio2_002364
KBio2_004932
KBio2_007500
KBio3_001881
ZOMSMJKLGFBRBS-UHFFFAOYSA-
BAS 35107H
BCP27977
HY-B2039
Tox21_201951
Tox21_300742
CCG-15052
1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-isopropyl-, 2,2-dioxide (8CI)
3-(1-Methylethyl)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide (8CI)
AKOS015897484
FB18172
1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-(1-methylethyl)-, 2,2-dioxide (9CI)
3-(1-Methylethyl)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide (8CI)(9CI)
NCGC00094531-01
NCGC00094531-02
NCGC00094531-03
NCGC00094531-04
NCGC00094531-05
NCGC00094531-06
NCGC00094531-07
NCGC00254648-01
NCGC00259500-01
DB-046610
B3825
Bentazon, PESTANAL(R), analytical standard
CS-0014134
NS00000236
3Isopropyl2,1,3benzothiadiazinon(4)2,2dioxid
F88281
3Isopropyl1Hbenzo2,1,3thiadiazin4one 2,2dioxide
A817619
EN300-11686574
Q148937
SR-01000388483
SR-01000388483-1
3-isopropyl-2,1,3-benzothiadiazin-4-one-2,2-dioxide
3Isopropyl1H2,1,3benzothiadiazin4(3H)one2,2dioxide
BRD-K33986892-001-02-3
Z56755983
1H2,1,3Benzothiadiazin4(3H)one2,2dioxide, 3isopropyl
3-Isopropyl-4-oxo-2,1,3-benzothiadiazine 2,2-dioxide
1H2,1,3Benzothiadiazin4(3H)one, 3isopropyl, 2,2dioxide
1H2,1,3Benzothiadiazin4(3H)one, 3(1methylethyl), 2,2dioxide
2,2-dioxo-3-propan-2-yl-1H-2|E6,1,3-benzothiadiazin-4-one
3(1Methylethyl)(1H)2,1,3benzothiadiazin4(3H)one2,2dioxide
1H2,1,3Benzothiadiazin4(3H)one, 3isopropyl, 2,2dioxide (8CI)
2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one
2,2-dioxo-3-propan-2-yl-1H-2lambda6,1,3-benzothiadiazin-4-one
2,2-dioxo-3-propan-2-yl-1H-benzo[d][1,2,6]thiadiazin-4-one
3(1Methylethyl)1H2,1,3benzothiadiazin4(3H)one 2,2dioxide (8CI)
1H2,1,3Benzothiadiazin4(3H)one, 3(1methylethyl), 2,2dioxide (9CI)
3(1Methylethyl)1H2,1,3benzothiadiazin4(3H)one 2,2dioxide (8CI)(9CI)
3-(1-Methylethyl)-1H-2,1,3-benzothia-diazin-4(3H)-one 2,2-dioxide
3-(1-methylethyl)-1H-2,1,3-benzothiadiazin- -4 (3H)-one-2,2-dioxide
3-(1-methylethyl)-1H-2,1,3-benzothiadiazin-4(3H)-one- -2,2-dioxide
3-(1-methylethyl)-1H-2,1,3-benzothiadiazin-4(3H)-one-2,2-dioxide
2,2-bis(oxidanylidene)-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one
246-585-8
3-(1-Methylethyl)-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide;3,4-Dihydro-3-isopropyl-1H-2,1,3-benzothiadiazin-4-one 2,2-dioxide;3-I sopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide
InChI=1/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3