ChemicalBook--->CAS DataBase List--->5398-77-6

5398-77-6

5398-77-6 Structure

5398-77-6 Structure
IdentificationMore
[Name]

4-Methylsulphonyl benzaldehyde
[CAS]

5398-77-6
[Synonyms]

4-METHANESULFONYL-BENZALDEHYDE
4-(METHYLSULFONYL)BENZALDEHYDE
4-METHYLSULPHONYL BENZALDEHYDE
p-methylsulphonyl benzaldehyde
TIMTEC-BB SBB005572
4-(Methylsulfonyl)benaldehyde
p-(Methyl-sulfonyl)benzaldehyde
P-MethylsufonylBenzaldehyde
4-(Methylsulphonyl)benzaldehyde 98%
4-METHYLSULPHONYLBENZALDEHYDE: 4-(METHYLSULFONYL)BENZALDEHYDE
4-Mesylbenzaldehyde
[EINECS(EC#)]

674-175-2
[Molecular Formula]

C8H8O3S
[MDL Number]

MFCD00216485
[Molecular Weight]

184.21
[MOL File]

5398-77-6.mol
Chemical PropertiesBack Directory
[Appearance]

light yellow-beige to light brown crystalline
[Melting point ]

155-161 °C
[Boiling point ]

288.16°C (rough estimate)
[density ]

1.3761 (rough estimate)
[refractive index ]

1.5151 (estimate)
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

Chloroform, Methanol
[form ]

Crystalline Powder or Crystals
[color ]

Light yellow-beige to light brown
[Stability:]

Hygroscopic
[InChI]

InChI=1S/C8H8O3S/c1-12(10,11)8-4-2-7(6-9)3-5-8/h2-6H,1H3
[InChIKey]

PSVPUHBSBYJSMQ-UHFFFAOYSA-N
[SMILES]

C(=O)C1=CC=C(S(C)(=O)=O)C=C1
[CAS DataBase Reference]

5398-77-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant
[HS Code ]

29130000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Description]

4-Methylsulfonyl benzaldehyde is an organic compound that can be synthesized by a number of different methods. It is soluble in water and has a melting point of about 212 degrees Celsius. It has been shown to have anti-cancer properties, as well as inhibitory effects on Cox-2 enzyme, which is involved in inflammation.
[Chemical Properties]

light yellow-beige to light brown crystalline
[Uses]

4-(Methylsulfonyl)benzaldehyde has been used in the preparation of arylidene-thiazolidinedione derivatives for the treatment of type 2 diabetes.
[Application]

4-Methylsulfonyl benzaldehyde has been used as a model for copper complexes, such as those found in wastewater treatment plants. It also shows promise for the removal of l-threonine from wastewater streams.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Methylsulphonyl benzaldehyde(5398-77-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Methylsulphonyl benzaldehyde, 95%(5398-77-6)
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