ChemicalBook--->CAS DataBase List--->4052-30-6

4052-30-6

4052-30-6 Structure

4052-30-6 Structure
IdentificationMore
[Name]

4-Methylsulphonylbenzoic acid
[CAS]

4052-30-6
[Synonyms]

4-METHANESULFONYL-BENZOIC ACID
4-(METHYLSULFONYL)BENZOIC ACID
4-METHYLSULPHONYLBENZOIC ACID
P-(METHYLSULFONYL)BENZOIC ACID
RARECHEM AL BO 1191
p-(methylsulphonyl)benzoic acid
4-Methylsulphonyl
4-(Methylsulphonyl)benzoic acid 98%
4-(Methylsulphonyl)benzoicacid98%
4-Carboxyphenyl methyl sulfone
4-Mesylbenzoic acid
[EINECS(EC#)]

223-756-5
[Molecular Formula]

C8H8O4S
[MDL Number]

MFCD00007564
[Molecular Weight]

200.21
[MOL File]

4052-30-6.mol
Chemical PropertiesBack Directory
[Appearance]

white powder
[Melting point ]

268-271 °C(lit.)
[Boiling point ]

307.93°C (rough estimate)
[density ]

1.4787 (rough estimate)
[refractive index ]

1.5500 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

slight
[form ]

powder to crystal
[pka]

pK1:3.64 (25°C)
[color ]

White to Almost white
[Water Solubility ]

slight
[InChI]

1S/C8H8O4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
[InChIKey]

AJBWNNKDUMXZLM-UHFFFAOYSA-N
[SMILES]

CS(=O)(=O)c1ccc(cc1)C(O)=O
[CAS DataBase Reference]

4052-30-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
[Safety Statements ]

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

3
[Hazard Note ]

Irritant
[HS Code ]

29163100
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

p-Methylsulfonylbenzoic acid(4052-30-6).msds
Hazard InformationBack Directory
[Chemical Properties]

white powder
[Uses]

4-(Methylsulfonyl)benzoic acid has pKa value of 3.48 and 8.36 in water and methanol at 25°C.
[General Description]

4-(Methylsulfonyl)benzoic acid has pKa value of 3.48 and 8.36 in water and methanol at 25°C.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Methylsulphonylbenzoic acid(4052-30-6)MS
4-Methylsulphonylbenzoic acid(4052-30-6)1HNMR
4-Methylsulphonylbenzoic acid(4052-30-6)13CNMR
4-Methylsulphonylbenzoic acid(4052-30-6)IR1
4-Methylsulphonylbenzoic acid(4052-30-6)IR2
4-Methylsulphonylbenzoic acid(4052-30-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Methylsulphonylbenzoic acid, 95%(4052-30-6)
[Alfa Aesar]

4-(Methylsulfonyl)benzoic acid(4052-30-6)
[Sigma Aldrich]

4052-30-6(sigmaaldrich)
[TCI AMERICA]

4-(Methylsulfonyl)benzoic Acid,>98.0%(GC)(T)(4052-30-6)
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