N-[(4-Methylphenyl)sulfonyl]glycine

Basic Information

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CAS Number

1080-44-0

Molecular Formula

C9H11NO4S

Molecular Weight

229.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

147.0 to 151.0 deg-C

Boiling Point

430°Cat760mmHg

Density

1.369

Flash Point

213.9°C

Refractive Index

1.567

SMILES

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

InChI

InChI=1S/C9H11NO4S/c1-7-2-4-8(5-3-7)15(13,14)10-6-9(11)12/h2-5,10H,6H2,1H3,(H,11,12)

InChIKey

VDKFCCZUCXYILI-UHFFFAOYSA-N

LogP

0.3579199999999998

Topological Polar Surface Area

83.47 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

312

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

Synonyms & References

English

CBDivE_003168
Glycine, N-[(4-methylphenyl)sulfonyl]-
N-p-toluenesulfonyl-dl-glycine
CS-0046764
T2803
Glycine, N-p-toluenesulfonyl-
BB 0219377
N-4-Tosylglycine
MFCD00045898
CHEMBL287486
1080-44-0
EU-0000679
SCHEMBL760439
DS-13625
SR-01000393622-1
J-002047
Tos-Gly-OH
N-p-Tosylglycine
N-(p-Toluenesulfonyl)glycine
2-(4-Methylphenylsulfonamido)acetic acid
NSC25821
n-(toluene-4-sulfonyl)glycine
DTXSID00148355
N-[(4-Methylphenyl)sulfonyl]glycne
J-523301
([(4-Methylphenyl)sulfonyl]amino)acetic acid #
N-Tosylglycine
NSC-25821
Glycine, N-((4-methylphenyl)sulfonyl)-
Oprea1_169137
AKOS001060050

MDL Number

MFCD00045898

Customs Code

2935009090

FAQ

What are the physical and chemical properties of N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0)?

N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0) is a crystalline solid with a molecular weight of approximately 275.25 g/mol. Its solubility in water is low, around 0.1 g/L. It is reactive due to the sulfonyl group, which can participate in various chemical reactions. It is stable under normal conditions but should be stored away from direct sunlight and heat.

How is N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0) typically synthesized?

N-[(4-Methylphenyl)sulfonyl]glycine is typically synthesized by the reaction of 4-methylphenyl sulfonyl chloride with glycine. The reaction involves the substitution of the amino group of glycine by the sulfonyl group from 4-methylphenyl sulfonyl chloride. The yield is generally high, and the use of a suitable catalyst can enhance the reaction selectivity.

What industries use N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0)?

N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0) is used in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in the polymer industry as a monomer, and in the semiconductor industry for the fabrication of electronic materials. Additionally, it is used in the development of sensors and other advanced materials.

What precautions should be taken when handling N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0)?

When handling N-[(4-Methylphenyl)sulfonyl]glycine (CAS: 1080-44-0), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Ensure that the work is conducted in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up immediately using appropriate materials, and the substance should be stored in a cool, dry place away from direct sunlight. Always consult the Safety Data Sheet (SDS) for detailed safety information.