CAS 118-91-2 2-Chlorobenzoic Acid Zone Refined (number of passes:20)

NAVIGATION

2-Chlorobenzoic Acid Zone Refined (number of passes:20)

PRICE INQUIRY

Catalog Number

ACM118912

CAS Number

118-91-2

Product Name

2-Chlorobenzoic Acid Zone Refined (number of passes:20)

Structure

Category

Other Material Building Blocks

Description

Crystals or fine fluffy white powder. (NTP, 1992)

IUPAC Name

2-chlorobenzoic acid

Molecular Weight

156.56g/mol

Molecular Formula

C7H5ClO2

Canonical SMILES

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

InChI

InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)

InChI Key

IKCLCGXPQILATA-UHFFFAOYSA-N

Boiling Point

Sublimes (NTP, 1992);287.0 °C

Melting Point

288 °F (NTP, 1992);140.2 °C;142 °C

Density

1.544 at 68 °F (NTP, 1992);1.544 AT 20 °C/4 °C

Solubility

less than 1 mg/mL at 68° F (NTP, 1992);0.01 M;SOL IN 900 PARTS COLD WATER; MORE SOL IN HOT WATER; FREELY SOL IN ALCOHOL, ETHER.;SOL IN ACETONE, BENZENE;SOLUBLE IN METHANOL;2087 mg/l at 25 °C in water

Application

The purpose of 2-Chlorobenzoic Acid Zone Refined (number of passes: 20) is to serve as a high-purity intermediate for various industrial and chemical applications. This compound, noted for its role as the strongest acid among the isomeric chlorobenzoic acids, is utilized in the synthesis of fungicides, insecticides, acaricides, and dyes due to its consistent chemical properties and improved purity obtained through multiple refining passes. Its solubility in methanol, anhydrous ethanol, ether, acetone, and benzene further enhances its versatility, making it a vital component in developing advanced chemical solutions and additives.

Color/Form

MONOCLINIC PRISMS FROM WATER

Complexity

136

Covalently-Bonded Unit Count

EC Number

204-285-4;247-558-3

Exact Mass

155.997807g/mol

Formal Charge

Heavy Atom Count

Log P

2.05 (LogP);log Kow= 2.05

MeSH Entry Terms

2-chlorobenzoate;2-chlorobenzoic acid;2-chlorobenzoic acid, copper (2+) salt;2-chlorobenzoic acid, nickel (2+) salt;2-chlorobenzoic acid, potassium salt

Monoisotopic Mass

155.997807g/mol

NSC Number

32737;15042

Rotatable Bond Count

UNII

8P0867193V

Vapor Pressure

6.60e-04 mmHg;6.6X10-4 mm Hg at 25 °C (extrapolated)

XLogP3

2.1

MSDS