3-DIMETHYLAMINO BENZOIC ACID

PRODUCT IDENTIFICATION

CAS NO. 99-64-9

3-DIMETHYLAMINO BENZOIC ACID

EINECS NO. 202-775-2
FORMULA (CH3)2NC6H4COOH
MOL WT. 165.19
H.S. CODE
TOXICITY
SYNONYMS m-(Dimethylamino)benzoic acid;
3-Dimethylaminobenzoesäure; ácido 3-dimetilaminobenzoico; N,N-Dimethyl-3- aminobenzoic acid; Acide 3-dimethylaminobenzoïque; m-N,N-(Dimethylamino)benzoic acid; 3-(Dimethylamino)benzoic acid; N,N-Dimethyl-m-aminobenzoic acid;
SMILES

 

CLASSIFICATION

 

PHYSICAL AND CHEMICAL PROPERTIES

PHYSICAL STATE white to yellowish crystalline powder
MELTING POINT 150 -153 C
BOILING POINT  
SPECIFIC GRAVITY
SOLUBILITY IN WATER Slight soluble

SOLVENT SOLUBILITY

Soluble in alcohol
AUTOIGNITION

 

pH

VAPOR DENSITY  
NFPA RATINGS Health: 1 Flammability: 1 Reactivity: 0
REFRACTIVE INDEX

 

FLASH POINT  
STABILITY Stable under ordinary conditions

APPLICATIONS

Benzoic acid derivatives substituted by hydroxy group or ether containing oxygen atom have active bacteriostatic and  fragrant properties. They are typically used in pharmaceutical and perfumery industry. The destructive metabolic property of oxygen containing benzoic acid derivatives such as protocatechuic acid (3,4-dihydroxybenzoic acid) and veratric acid (3,4-dimethoxybenzoic acid) is used in the application for pharmaceuticals. Protocatechuic acid is a catabolite of epinephrine. Prazosin, a peripheral vasodilator and antihypertensive, is also an example of the applicaion of veratric acid. Hydroxy and ether substituted benzoic acids feature analogue metabolite of aspirin (acetylsalicylic Acid). They are used as intermediates for pharmaceuticals (especially for antipyetic anlgesic, antirheumatism) and other organic synthesis. They are used as matrix for ionization of peptides, proteins and carbohydrates.

Benzoic acid, the simplest aromatic carboxylic acid containing carboxyl group bonded directly to benzene ring, is a white, crystalline organic compound; melting at 122 C (starting sublime at 100 C);  boiling at 249 C; slightly soluble in water, soluble in ethanol, very slightly soluble in benzene and acetone. Its aqua solution is weakly acidic. It occurs naturally in many plants  and resins. Benzoic acid is also detected in animals. The most of commercial benzoic acid is produced by the reaction of toluene with oxygen at temperatures around 200 C in the liquid phase and in the presence of cobalt and manganese salts as catalysts. It can be prepared also by the oxidation of benzene with concentrated sulphuric acid or carbon dioxide in the presence of catalysts. Other methods are such as by the oxidation of benzyl alcohol, benzaldehyde, cinnamic acid; by hydrolysis of benzonitrile, benzoyl chloride. More than 90% of commercial benzoic acid is converted directly to phenol and caprolactam. Its use in the production of glycol benzoates for the application of plasticizer in adhesive formulations is increasing. It is also used in the manufacture of alkyd resins and drilling mud additive for crude oil recovery applications. It is used as a rubber polymerization activators and retardants. Benzoic acid is converted to its salts and esters for the use of preservative application in foods, drugs and personal products. Sodium benzoate, sodium salt of benzoic acid, is used preferably as one of the principal anti-microbial preservatives used in foods and beverages (but it's concentration is limited usually not exceeding 0.1% because it is poisonous), as it is about 200 times more soluble than benzoic acid. Sodium Benzoate is also used in medications, anti-fermentation additives and tabletting lubricant for pharmaceuticals. The industrial applications are as a corrosion inhibitor, as an additive to automotive engine antifreeze coolants and in other waterborne systems, as a nucleating agents for polyolefin, as a dye intermediate, as a stabilizer in photographic processing and as a catalyst. Wide range of benzoic esters are used as solvents, dying carrier, disinfectant additive, penetrating agent and pesticides and manufacturing other compounds.

p-Aminobenzoic acid is a part of the folic acid molecule. It was called Vitamin BX as it is a component of pteroylglutamate. But It is considered it does not contribute to synthesize folate in human body. Vitmin BX does not exist as PABA.  In industrial field, it is a starting material in the manufacture of target esters, , salts, folic acid, azo dyes and other organic compounds. It is used as an UV-blocking ingredient in sun tan cosmetics. It is used in medical field for preparing local anesthetic and ointments.  There are three structural isomers. amino group substituted benzoic acid at relative to the hydroxyl group, ortho-, meta-, and para-Aminobenzoic acid. The names of the three compounds indicate which of the hydrogens on the benzene ring portion of the molecule have been replaced. Aminobenzoic acids their derivatives are important for the preparation of other pharmaceutical products, dyes, flavours, and preservatives.

SALES SPECIFICATION

APPEARANCE

White to yellowish crystalline powder
PURITY 99.0% min

MELTING POINT

150  - 153 C

WATER

0.5% max

HEAVY METALS

20ppm max

TRANSPORTATION
PACKING 25kgs in fiber drum
HAZARD CLASS Not regulated
UN NO.  
OTHER INFORMATION
Hazard Symbols: n/a, Risk Phrases: n/a, Safety Phrases: 24/25