Methyl 4-Phenylbenzoate

Basic Information

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CAS Number

720-75-2

Molecular Formula

C14H12O2

Molecular Weight

212.25 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

Melting Point

118 ºC

Boiling Point

307.8°C at 760 mmHg

Density

1.048

Flash Point

132.7°C

Refractive Index

1.517

SMILES

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COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H12O2/c1-16-14(15)13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3

InChIKey

GATUGNVDXMYTJX-UHFFFAOYSA-N

LogP

3.140200000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

223

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-Phenylbenzoic acid methyl ester
Methyl 4-biphenylcarboxylate
MFCD00017200
AKOS000277176
NSC 234749
DTXSID8061054
SCHEMBL1105491
CS-W015012
[1, methyl ester
W-104500
Methyl[1,1'-biphenyl]-4-carboxylate
NSC16285
A837413
Methyl 4-phenylbenzoate
Methyl-4-phenylbenzoate
D97462
NSC-234749
Methyl [1,1'-biphenyl]-4-carboxylate
UNII-Y85RBC5X3U
Methyl biphenyl-4-carboxylate
Methyl p-phenylbenzoate
NSC 16285
NSC234749
GATUGNVDXMYTJX-UHFFFAOYSA-N
FT-0617684
NS00037329
[1,1'-Biphenyl]-4-carboxylic acid, methyl ester
4-[bis[4-(dimethylamino)phenyl]methyl]-2-ethoxy-phenol
4-Biphenylcarboxylic acid, methyl ester
EINECS 211-954-4
p-Phenylbenzoic acid methyl ester

MDL Number

MFCD00017200

Customs Code

2916399090

FAQ

What regulatory guidelines apply to Methyl 4-Phenylbenzoate (CAS: 720-75-2)?

Methyl 4-Phenylbenzoate (CAS: 720-75-2) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a skin and eye irritant. In the European Union, it falls under the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulation. The U.S. Food and Drug Administration (FDA) may regulate it as a food contact substance, and the U.S. Environmental Protection Agency (EPA) may regulate it as a pesticide or industrial chemical.

Are there alternatives to Methyl 4-Phenylbenzoate (CAS: 720-75-2) in synthesis?

Alternatives to Methyl 4-Phenylbenzoate include other aromatic esters such as Ethyl 4-Phenylbenzoate and Propyl 4-Phenylbenzoate. Isomers of methyl 4-phenylbenzoate can also be used as alternatives. Commonly, synthetic routes involving phenylacetic acid and phenol can be used to produce alternatives, such as Phenylacetic acid methyl ester and 4-Hydroxybenzoic acid methyl ester.

What is the market or research trend for Methyl 4-Phenylbenzoate (CAS: 720-75-2)?

The market for Methyl 4-Phenylbenzoate is driven by its use in fragrances and flavorings. Research trends include its application in cosmetic and pharmaceutical industries. Recent studies focus on its potential as a bioactive compound, particularly in neuroprotective and antioxidant properties. Price trends indicate a steady demand with minor fluctuations based on supply and demand in the fragrance market.

How should waste containing Methyl 4-Phenylbenzoate (CAS: 720-75-2) be handled?

Waste containing Methyl 4-Phenylbenzoate (CAS: 720-75-2) should be handled by first collecting it in a sealed container. Incineration is a common method for disposal, but ensure it is conducted in an appropriately licensed facility to comply with environmental regulations. Alternatively, professional waste disposal services can handle the waste, which includes proper treatment to minimize environmental impact. Always adhere to local waste disposal laws and regulations.