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
3-Chlorobenzoic acid Property
- Melting point:
- 153-157 °C (lit.)
- Boiling point:
- 274-276°C
- Density
- 1.496
- 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)
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)
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.
N-Bromosuccinimide Price
- Product number
- C24604
- Product name
- 3-Chlorobenzoic acid
- Purity
- ReagentPlus , ≥99%
- Packaging
- 25g
- Price
- $41.6
- Updated
- 2024/03/01
- Product number
- NIST2144
- Product name
- m-Chlorobenzoic acid
- Purity
- NIST? SRM? 2144
- Packaging
- 2g
- Price
- $731
- Updated
- 2024/03/01
- Product number
- 1112299
- Product name
- 3-Chlorobenzoic acid
- Purity
- United States Pharmacopeia (USP) Reference Standard
- Packaging
- 25mg
- Price
- $1380
- Updated
- 2024/03/01
- Product number
- C0132
- Product name
- 3-Chlorobenzoic Acid
- Purity
- >99.0%(GC)(T)
- Packaging
- 25g
- Price
- $30
- Updated
- 2024/03/01
- Product number
- C0132
- Product name
- 3-Chlorobenzoic Acid
- Purity
- >99.0%(GC)(T)
- Packaging
- 500g
- Price
- $300
- Updated
- 2024/03/01
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
Preparation Products
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View Lastest Price from 3-Chlorobenzoic acid manufacturers
- 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
- 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
- Product
- 3-Chlorobenzoic acid 535-80-8
- Price
- US $100.00/bag
- Min. Order
- 1bag
- Purity
- 99
- Supply Ability
- 5000
- Release date
- 2023-08-30