Methyl 3-(4-methylbenzenesulfonamido)benzoate

Basic Information

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CAS Number

173436-66-3

Molecular Formula

C15H15NO4S

Molecular Weight

305.36 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C15H15NO4S/c1-11-6-8-14(9-7-11)21(18,19)16-13-5-3-4-12(10-13)15(17)20-2/h3-10,16H,1-2H3

InChIKey

CVKBYFCJQSPBOI-UHFFFAOYSA-N

LogP

2.582420000000001

Topological Polar Surface Area

72.47 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

449

Synonyms & References

English

Benzoic acid, 3-[[(4-methylphenyl)sulfonyl]amino]-, methyl ester
3-[[(4-Methylphenyl)sulfonyl]amino]-benzoic acid methyl ester
Methyl 3-{[(4-methylphenyl)sulfonyl]amino}benzoate
WI-21
MSAB
SR-01000367943
EN300-318128
MS-24413
METHYL 3-(4-METHYLBENZENESULFONAMIDO)BENZOATE
methyl 3-((4-methylphenyl)sulfonamido)benzoate
MFCD00994918
173436-66-3
MSAB, >=95% (HPLC)
CHEMBL5189621
MSAB?
SCHEMBL16116948
Methyl 3-(4-methylphenylsulfonamido)benzoate
Z45583786
EX-A4298
STK408576
s6901
CS-0078728
methyl 3-[(4-methylphenyl)sulfonylamino]benzoate
AKOS000511305
E74501
SR-01000367943-1
METHYL3-(4-METHYLBENZENESULFONAMIDO)BENZOATE
methyl 3-[(4-methylphenyl)sulfonyl]amino-benzoate
AC-36552
HY-120697
methyl 3-{[(4-methylphenyl)sulfonyl]amino}benzoate

MDL Number

MFCD00994918

FAQ

What is Methyl 3-(4-methylbenzenesulfonamido)benzoate (CAS: 173436-66-3)?

Methyl 3-(4-methylbenzenesulfonamido)benzoate is an organic compound with the CAS number 173436-66-3. It is a white crystalline solid with a molecular formula of C15H13NO4S. The compound is characterized by its solubility in polar solvents and has a pungent odor. It is used as a precursor in the synthesis of various pharmaceuticals and chemical intermediates.

What are the main uses of Methyl 3-(4-methylbenzenesulfonamido)benzoate (CAS: 173436-66-3)?

Methyl 3-(4-methylbenzenesulfonamido)benzoate is primarily used as a precursor in the synthesis of various pharmaceuticals, such as analgesics and anti-inflammatory drugs. It also serves as a chemical intermediate in the production of other compounds with similar functional groups. Additionally, it can be used in research for developing new drug candidates.

Is Methyl 3-(4-methylbenzenesulfonamido)benzoate (CAS: 173436-66-3) safe?

Methyl 3-(4-methylbenzenesulfonamido)benzoate is generally considered safe when handled with appropriate precautions. However, it should be used and stored in accordance with safety guidelines. Direct contact with skin and inhalation of dust should be avoided. It is recommended to wear protective gloves, goggles, and a lab coat when handling the compound. Proper ventilation is also necessary to prevent inhalation of vapors.

How should Methyl 3-(4-methylbenzenesulfonamido)benzoate (CAS: 173436-66-3) be stored?

Methyl 3-(4-methylbenzenesulfonamido)benzoate should be stored in a cool, dry place away from direct sunlight and heat sources. It is advisable to keep it in a tightly sealed container to prevent exposure to moisture and air. The storage temperature should be between 15-25°C (59-77°F). Avoid storing it near incompatible materials such as strong acids and bases. It is recommended to store it in a well-ventilated area to minimize the risk of fire and inhalation of dust.