N-(2,5-Dichlorobenzoyl)glycine

Basic Information

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CAS Number

667403-46-5

Molecular Formula

C9H7Cl2NO3

Molecular Weight

248.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

420.6°C at 760 mmHg

Density

1.505

Flash Point

208.2°C

Refractive Index

1.593

SMILES

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C1=CC(=C(C=C1Cl)C(=O)NCC(=O)O)Cl

InChI

InChI=1S/C9H7Cl2NO3/c10-5-1-2-7(11)6(3-5)9(15)12-4-8(13)14/h1-3H,4H2,(H,12,15)(H,13,14)

InChIKey

HKUAUZSWGMQPOK-UHFFFAOYSA-N

LogP

1.8077999999999999

Topological Polar Surface Area

66.4 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

260

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

CHEMBRDG-BB 7959525
SCHEMBL8002583
2-(2,5-Dichlorobenzamido)acetic acid
2-[(2,5-dichlorobenzoyl)amino]acetic acid
667403-46-5
AC-29977
AKOS000158964
F16321
UNII-QQH7JVD5TT
AMY39521
QQH7JVD5TT
2-(2,5-Dichlorobenzamido)aceticacid
Ixazomib metabolite M12
AS-10002
N-[(2,5-dichlorophenyl)carbonyl]glycine
DTXSID60602726
A856575
[(2,5-DICHLOROPHENYL)FORMAMIDO]ACETIC ACID
N-(2,5-DICHLOROBENZOYL)GLYCINE
ML701201
MFCD03175234
C9H7Cl2NO3
SY059075
CS-0151392
Glycine, N-(2,5-dichlorobenzoyl)-
CHEMBRDG-BB
[2,5-dichlorobenzoylamino]acetic acid
AG-G-51848
Ambcb7959525
CTK5C5129
SureCN8002583

MDL Number

MFCD03175234

Customs Code

2924299090

FAQ

What are the physical and chemical properties of N-(2,5-Dichlorobenzoyl)glycine (CAS: 667403-46-5)?

N-(2,5-Dichlorobenzoyl)glycine is a white to off-white solid with a crystalline form. Its molecular weight is approximately 273.04 g/mol. The compound is slightly soluble in water and more soluble in organic solvents. It shows low reactivity in most conditions but can undergo hydrolysis under basic conditions. The compound is stable under normal storage conditions but should be protected from moisture and heat.

How is N-(2,5-Dichlorobenzoyl)glycine (CAS: 667403-46-5) typically synthesized?

N-(2,5-Dichlorobenzoyl)glycine is typically synthesized through the coupling reaction of 2,5-dichlorobenzoyl chloride with glycine. This reaction is catalyzed by a Lewis acid such as aluminum chloride and proceeds under anhydrous conditions. The yield is usually around 70-80%, with good selectivity for the desired product. The reaction can be carried out in an appropriate solvent such as dichloromethane or acetonitrile.

What industries use N-(2,5-Dichlorobenzoyl)glycine (CAS: 667403-46-5)?

N-(2,5-Dichlorobenzoyl)glycine is used in various industries. It is a key intermediate in the synthesis of pharmaceuticals, particularly in the development of antifungal and antibiotic agents. It also finds applications in the production of certain polymers and sensors. Additionally, its unique structure makes it useful in the field of semiconductor materials for specific applications.

What precautions should be taken when handling N-(2,5-Dichlorobenzoyl)glycine (CAS: 667403-46-5)?

When handling N-(2,5-Dichlorobenzoyl)glycine, it is important to use appropriate personal protective equipment (PPE), including gloves, safety goggles, and lab coat. The compound should be stored in a cool, dry place, away from moisture and heat. In case of spill, it should be immediately cleaned up using appropriate safety measures. It is advisable to keep the safety data sheet (SDS) readily available for reference. The compound is not highly reactive but should still be handled with care to avoid potential irritation or inhalation.