[4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid

Basic Information

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CAS Number

492445-92-8

Molecular Formula

C11H12N2O3

Molecular Weight

220.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Refractive Index

1.604

SMILES

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O=C(O)CC1=CC=C(N2CCNC2=O)C=C1

InChI

InChI=1S/C11H12N2O3/c14-10(15)7-8-1-3-9(4-2-8)13-6-5-12-11(13)16/h1-4H,5-7H2,(H,12,16)(H,14,15)

InChIKey

SAUIBPUGJQBOSH-UHFFFAOYSA-N

LogP

0.8432999999999999

Topological Polar Surface Area

69.64 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

285

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

2-(4-(2-Oxoimidazolidin-1-yl)phenyl)acetic acid
[4-(2-Oxo-imidazolidin-1-yl)-phenyl]-acetic acid
2-[4-(2-oxoimidazolidin-1-yl)phenyl]acetic acid
4-(2-oxo-1-imidazolidinyl)Benzeneacetic acid
[4-(2-oxoimidazolidin-1-yl)phenyl]acetic acid(SALTDATA: FREE)
2-[4-(2-oxo-1-imidazolidinyl)phenyl]acetic acid
[4-(2-Oxoimidazolidin-1-yl)phenyl]acetic acid
[4-(2-OXO-1-IMIDAZOLIDINYL)PHENYL]ACETIC ACID
AB22819
ST2416088
AX8024218
W6499
[4-(2-Oxo-imidazoli

MDL Number

MFCD05864552

Customs Code

2933990090

FAQ

What are the physical and chemical properties of [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8)?

The compound [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8) is a crystalline solid with a molecular weight of approximately 245.23 g/mol. It has a pKa value of about 3.9 and is soluble in common organic solvents such as methanol and acetone. It is less soluble in water. The compound is relatively stable under normal conditions but can react with bases to form the corresponding salt.

How is [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8) typically synthesized?

The compound [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8) can be synthesized via a multi-step reaction involving the condensation of a substituted imidazolidine with a phenyl acetic acid derivative. This process typically uses a mild base like triethylamine and is conducted at room temperature. The overall yield is around 70-80%, depending on the purity of the starting materials.

What industries use [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8)?

The compound [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8) is primarily used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It also finds applications in the polymer industry, where it can be used as a monomer. Additionally, it has potential uses in the development of sensors and semiconductors due to its chemical reactivity and functional groups.

What precautions should be taken when handling [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8)?

When handling [4-(2-Oxo-1-imidazolidinyl)phenyl]acetic acid (CAS: 492445-92-8), it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. The compound should be managed in a well-ventilated area, preferably in a fume hood, to minimize inhalation risks. Spills should be cleaned up immediately using appropriate spill kits, and proper disposal methods should be followed. For detailed safety information, refer to the Material Safety Data Sheet (MSDS/SDS).