ChemicalBook > CAS DataBase List > 3-Chlorobenzoic acid

3-Chlorobenzoic acid

Product Name
3-Chlorobenzoic acid
CAS No.
535-80-8
Chemical Name
3-Chlorobenzoic acid
Synonyms
MCBA;M-CHLOROBENZOIC ACID;3-chlorobenzoic;3-Chlorbenzoesαure;3-Chlorobenzoi;m-Chlorobenzoic;3-CHLOROBENZOATE;AKOS BBS-00003733;m-Chlorbenzoesαure;m-Chlorbenzoesαure
CBNumber
CB7203275
Molecular Formula
C7H5ClO2
Formula Weight
156.57
MOL File
535-80-8.mol
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3-Chlorobenzoic acid Property

Melting point:
153-157 °C (lit.)
Boiling point:
274-276°C
Density 
1.496
bulk density
600kg/m3
refractive index 
1.5812 (estimate)
Flash point:
150 °C
storage temp. 
Store below +30°C.
solubility 
0.45g/l
form 
Crystalline Powder
pka
3.82(at 25℃)
color 
White to beige
Water Solubility 
<0.1 g/100 mL at 19.5 ºC
Merck 
14,2123
BRN 
907218
Stability:
Skin, eye and respiratory irritant.
CAS DataBase Reference
535-80-8(CAS DataBase Reference)
NIST Chemistry Reference
Benzoic acid, 3-chloro-(535-80-8)
EPA Substance Registry System
m-Chlorobenzoic acid (535-80-8)
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36-37/39
WGK Germany 
3
RTECS 
DG4975990
Autoignition Temperature
>500 °C
TSCA 
Yes
HS Code 
29163900
Hazardous Substances Data
535-80-8(Hazardous Substances Data)
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P337+P313IF eye irritation persists: Get medical advice/attention.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
C24604
Product name
3-Chlorobenzoic acid
Purity
ReagentPlus , ≥99%
Packaging
25g
Price
$41.6
Updated
2024/03/01
Sigma-Aldrich
Product number
NIST2144
Product name
m-Chlorobenzoic acid
Purity
NIST? SRM? 2144
Packaging
2g
Price
$731
Updated
2024/03/01
Sigma-Aldrich
Product number
1112299
Product name
3-Chlorobenzoic acid
Purity
United States Pharmacopeia (USP) Reference Standard
Packaging
25mg
Price
$1380
Updated
2024/03/01
TCI Chemical
Product number
C0132
Product name
3-Chlorobenzoic Acid
Purity
>99.0%(GC)(T)
Packaging
25g
Price
$30
Updated
2024/03/01
TCI Chemical
Product number
C0132
Product name
3-Chlorobenzoic Acid
Purity
>99.0%(GC)(T)
Packaging
500g
Price
$300
Updated
2024/03/01
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3-Chlorobenzoic acid Chemical Properties,Usage,Production

Chemical Properties

white to light yellow crystal powder

Uses

A Pseudomonas species which utilized 3-chlorobenzoic acid as a carbon source converted this compound to 3-hydroxybenzoic and 2, 5-dihydroxybenzoic acids. A methanogenic consortium able to use 3-chlorobenzoic acid as its sole energy and carbon source was enriched from anaerobic sewage sludge. A Pseudomonas putida strain 87 capable of assimilating 3-chlorobenzoic acid as a sole source of carbon and energy (3Cba+) was isolated. coupling of 3-chlorobenzoic acid with phenylboronic acid proceeds at room temperature using 0.5 % Pd and at 100°C using 0.1 % Pd to provide the coupled product in 97 % yeild.

Uses

3-Chlorobenzoic acid is a fundamental chemical building block commonly used in organic synthesis of more complex structures. A benzoic acid analogue that showed antifungal activity against strains of Aspergillus flavus, Aspergillus fumigatus and Aspergillus terreus, causative agents of human aspergillosis, in in vitro bioassays.

Definition

ChEBI: 3-chlorobenzoic acid is a monochlorobenzoic acid carrying a chloro substituent at position 3. It has a role as a drug metabolite. It is functionally related to a benzoic acid. It is a conjugate acid of a 3-chlorobenzoate.

Synthesis Reference(s)

Journal of the American Chemical Society, 76, p. 5755, 1954 DOI: 10.1021/ja01651a039
Tetrahedron Letters, 25, p. 783, 1984

General Description

Crystals or fluffy white powder.

Air & Water Reactions

Insoluble in water.

Reactivity Profile

3-Chlorobenzoic acid is incompatible with strong oxidizing agents. The reactivity of the chlorine atom of 3- chlorobenzoic acid is sluggish compared with the other isomers. Decarboxylation at higher temperatures is insignificant, and it resists oxidation. 3-Chlorobenzoic acid is made by the oxidation of 3-chlorotoluene or by the hydrolysis of 3-chlorobenzoyl chloride, which is derived from benzoyl chloride. 3-Chlorobenzoic acid is used for making diphenyl ether type herbicides.

Fire Hazard

Flash point data for 3-Chlorobenzoic acid are not available; however, 3-Chlorobenzoic acid is probably combustible.

Purification Methods

Crystallise the acid successively from glacial acetic acid, aqueous EtOH and pet ether (b 60-80o). It also recrystallises from *C6H6 or Et2O/hexane, and sublimes at 55o in a vacuum. [Anal Chem 26 726 1954] The methyl ester has m 21o, b 231o/760mm. The S-benzylisothiouronium salt has m 164-165o (from EtOH) [Friediger & Pedersen Acta Chem Scand 9 1425 1955, Samuel J Chem Soc 1318 1960]. [Beilstein 9 IV 969.]

3-Chlorobenzoic acid Preparation Products And Raw materials

Raw materials

2-Amino-5-chlorobenzoic acid Silver chloride 3,5-Dichlorobenzoic acid 3-Chlorotoluene m-Chlorotrichlorotoluene

Preparation Products

(S)-3-Aminoquinuclidine dihydrochloride 6-CHLOROISOBENZOFURAN-1(3H)-ONE
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3-Chlorobenzoic acid Suppliers

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View Lastest Price from 3-Chlorobenzoic acid manufacturers

Speranza Chemical Co., Ltd.
Product
3-Chlorobenzoic acid 535-80-8
Price
US $20.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
200tons/ year
Release date
2020-03-11
Moxin Chemicals
Product
Bupropion Impurity 15 535-80-8
Price
US $0.00-0.00/mg
Min. Order
10mg
Purity
95%+
Supply Ability
10000
Release date
2025-01-21
WUHAN FORTUNA CHEMICAL CO., LTD
Product
3-Chlorobenzoic acid 535-80-8
Price
US $0.00/KG
Min. Order
1KG
Purity
98%min
Supply Ability
30tons/month
Release date
2023-02-06

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