Methyl N-[(4-methylphenyl)sulfonyl]glycinate

Basic Information

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CAS Number

2645-02-5

Molecular Formula

C10H13NO4S

Molecular Weight

243.28 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

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

89-91 ºC

Boiling Point

240.5±23.0℃ at 760 mmHg

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC

InChI

InChI=1S/C10H13NO4S/c1-8-3-5-9(6-4-8)16(13,14)11-7-10(12)15-2/h3-6,11H,7H2,1-2H3

InChIKey

GYQBPYXMRNEAKZ-UHFFFAOYSA-N

LogP

0.44631999999999966

Topological Polar Surface Area

72.47 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

325

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

FT-0698128
SCHEMBL570839
2645-02-5
Z19154190
SR-01000402427-1
CHEMBL1569191
Methyl ([(4-methylphenyl)sulfonyl]amino)acetate #
N-tosylglycine methyl ester
CA-0008
EN300-7368666
CAA64502
AC-25707
A24542
AKOS001040901
methyl 2-[(4-methylphenyl)sulfonylamino]acetate
N-(Toluene-4-sulphonyl)glycine methyl ester
MLS000571064
BDBM50130031
Ts-Gly-OMe
HMS1608L01
HMS2312K08
N-(p-Toluenesulfonyl)glycine Methyl Ester
MFCD00558890
Oprea1_145719
CS-W005546
p-toluenesulfonylglycine methyl ester
Tos-Gly-Ome
(TOLUENE-4-SULFONYLAMINO)-ACETIC ACID METHYL ESTER
Glycine, N-[(4-methylphenyl)sulfonyl]-, methyl ester
Acetic acid, 2-(4-methylphenylsulfonylamino)-, methyl ester
methyl 2-(4-methylbenzenesulfonamido)acetate

MDL Number

MFCD00558890

Customs Code

2935009090

FAQ

What regulatory guidelines apply to Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5)?

Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5) is subject to various regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA requirements. It must be classified and labeled according to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), and its manufacture, import, and use in the European Union is regulated under the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulation. Additionally, it is subject to local and national regulations and guidelines in the USA, such as those set by the EPA and FDA.

Are there alternatives to Methyl N-[(4-methylphenyl)sulfonyl]glycinate in synthesis?

There are several alternatives to Methyl N-[(4-methylphenyl)sulfonyl]glycinate in synthesis. For example, other sulfonamides or alternative glycinates can be used, depending on the specific application. Common alternatives include N-[(4-methylphenyl)sulfonyl]glycine or other similar compounds that can serve as precursors or intermediates in similar reactions. These alternatives can offer similar functionalities or may have different physical or chemical properties that make them suitable for specific applications.

What is the market or research trend for Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5)?

The market for Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5) is primarily driven by its use as an intermediate in the synthesis of pharmaceuticals and agricultural chemicals. Research trends indicate an increasing focus on sustainable and environmentally friendly synthesis methods, which may drive the development of green chemistry alternatives. Additionally, there is growing interest in the compound's potential applications in materials science and as a building block for complex molecules.

How should waste containing Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5) be handled?

Waste containing Methyl N-[(4-methylphenyl)sulfonyl]glycinate (CAS: 2645-02-5) should be collected and handled in accordance with local and national regulations. It is recommended to store waste in sealed containers to prevent contamination and ensure the safety of handling. For disposal, it is advisable to use professional waste disposal services that specialize in chemical waste management. Incineration is a common method for disposing of such waste, but it must be done in an environmentally friendly manner to comply with regulations. Additionally, proper environmental precautions should be taken to minimize the impact on the environment.