2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide

Basic Information

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CAS Number

77-36-1

Molecular Formula

C14H11ClN2O4S

Molecular Weight

338.77 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

217-225°C

Boiling Point

No data available

Density

1.3356 (rough estimate)

Flash Point

No data available

Solubility

DMSO: soluble5mg/mL, clear (warmed)

Refractive Index

1.5630 (estimate)

SMILES

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C1=CC=C2C(=C1)C(=O)NC2(C3=CC(=C(C=C3)Cl)S(=O)(=O)N)O

InChI

InChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)

InChIKey

JIVPVXMEBJLZRO-UHFFFAOYSA-N

LogP

0.9242000000000007

Topological Polar Surface Area

109.49000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 6

Complexity

564

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Prestwick3_000351
CHLORTALIDONE [WHO-DD]
Racemic chlorthalidone
D00272
2-chloro-5-[(1S)-1-hydroxy-3-oxo-isoindolin-1-yl]benzenesulfonamide;Chlorthalidone
(.+/-.)-Chlorthalidone
Chlorthalidone (Chlortalidone)
KS-1342
Z1741981513
Zambesil
CHLORTHALIDONE COMPONENT OF CLORPRES
SMR000058635
A839067
KBio2_000626
Oxodolin
C14H11ClN2O4S
SPBio_000058
KBioGR_001574
CHLORTALIDONE [EP MONOGRAPH]
BPBio1_000487
Saluretin
74658-80-3
NINDS_000731
NCGC00094616-03
EN300-18527725
NSC 69200
Spectrum_000146
CHLORTHALIDONE [USP MONOGRAPH]
D09NIA
Oksodolin (oxodolin)
Oradil

MDL Number

MFCD00036257

Customs Code

2935009090

FAQ

What are the physical and chemical properties of 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1)?

2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1) is not a widely recognized compound, but it exhibits typical properties for a benzene derivative. It crystallizes as a white or off-white solid. The molecular weight is approximately 328.66 g/mol. It has low water solubility and is poorly soluble in common organic solvents. It is chemically stable under normal conditions but reacts with strong bases to form its conjugate base. For precise physical and chemical properties, refer to detailed chemical literature or databases.

How is 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1) typically synthesized?

The synthesis of 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1) is not well documented. However, it could be synthesized through a series of steps including chlorination, condensation, and sulfonamidation. The exact route and conditions would require detailed organic synthesis expertise and might involve the use of catalysts and reagents. For a specific synthesis method, consult a professional chemist or chemical literature.

What industries use 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1)?

2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1) is not commonly used in any major industries. It may have niche applications in specialized research or as an intermediate in complex organic syntheses. Its primary uses would depend on its unique chemical properties and could potentially be explored in pharmaceuticals or polymer science. Further investigation would be required to determine its specific industrial applications.

What precautions should be taken when handling 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1)?

When handling 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide (CAS: 77-36-1), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Handle with care to avoid skin contact and inhalation of vapors. If spillage occurs, follow standard laboratory safety procedures and refer to the Material Safety Data Sheet (MSDS) for specific instructions. Ensure all waste is disposed of properly and in accordance with local regulations.