2-Benzoylbenzoic Acid

Basic Information

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CAS Number

85-52-9

Molecular Formula

C14H10O3

Molecular Weight

226.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

128.0 to 131.0 deg-C

Boiling Point

257-265 °C

Density

1.2022 (rough estimate)

Flash Point

257°C

Refractive Index

1.5767 (estimate)

SMILES

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C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H10O3/c15-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)14(16)17/h1-9H,(H,16,17)

InChIKey

FGTYTUFKXYPTML-UHFFFAOYSA-N

LogP

2.615800000000001

Topological Polar Surface Area

54.37 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

292

Safety Information

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Hazard Statement

H303 May be harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

UNII-1N20Y812XW
4-10-00-02977 (Beilstein Handbook Reference)
2-benzoylbenzoesyre
(pS)-2-Benzoylbenzoic acid
AC-2859
Benzoylbenzoesaure
2-Benzoquinonecarboxylic acid
Oprea1_391180
1-carboxy-2-phenylcarbonylbenzene
2-BENZOQUINONECARBOXYLIC ACID [HSDB]
AG-205/01795007
2-benzoyl benzoic acid
BDBM50174202
NSC 6646
EN300-19131
HSDB 5249
SR-01000596918-1
benzoyl benzoic acid
2-Benzoylbenzoic acid, 98%
o-Benzoylbenzoic acid
DTXSID6058924
1N20Y812XW
LS-36099
BBL007937
Z104472890
AKOS000118995
2-(phenylcarbonyl)benzoic acid
STR03489
o-benzoyl benzoic acid
SKP 10A
NSC-6646

MDL Number

MFCD00002472

Customs Code

2918300090

FAQ

What is 2-Benzoylbenzoic Acid (CAS: 85-52-9)?

2-Benzoylbenzoic Acid, with the CAS number 85-52-9, is an aromatic carboxylic acid. It has the chemical formula C14H10O3 and is known for its white crystalline solid form. It is commonly used as an intermediate in organic synthesis and exhibits good solubility in organic solvents. Its molecular structure consists of two benzene rings connected by a carbonyl group and a carboxylic acid functional group.

What are the main uses of 2-Benzoylbenzoic Acid (CAS: 85-52-9)?

2-Benzoylbenzoic Acid is primarily used in the pharmaceutical industry as a precursor for various drugs. It also serves as a key component in the synthesis of dyes, pigments, and other organic compounds. Additionally, it is employed in research for developing new materials and in industrial applications for creating specialty chemicals. Its versatility makes it valuable in multiple sectors.

Is 2-Benzoylbenzoic Acid (CAS: 85-52-9) safe?

2-Benzoylbenzoic Acid is generally considered safe when handled properly. However, it should be treated with caution as it may cause skin and eye irritation. Protective gloves, goggles, and a well-ventilated workspace are recommended. It is not classified as toxic under standard safety guidelines, but proper disposal and storage are necessary to ensure environmental safety.

How should 2-Benzoylbenzoic Acid (CAS: 85-52-9) be stored?

2-Benzoylbenzoic Acid should be stored in a cool, dry, and dark place, away from moisture and light. It is best kept in a sealed container made of glass or plastic to prevent contamination. Storage temperature should be maintained below 25°C, and it should be protected from exposure to air. Proper labeling and storage conditions are essential for maintaining its stability and effectiveness.