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69-72-7

Basic Information
CAS No.: 69-72-7
Name: Salicylic acid
Article Data: 719
Cas Database
Molecular Structure:
Molecular Structure of 69-72-7 (Salicylic acid)
Formula: C7H6O3
Molecular Weight: 138.123
Synonyms: SAX;Salicylic Acid(Medical);Salicylic Acid (technical grade);Salicylic Acid(natural);Dr. Scholls Corn Removers;o-Hydroxybenzoic acid;Freezone;Stri-Dex;Compound W;K 537;54-21-7;Phenol-2-carboxylic acid;2-Hydroxybenzenecarboxylic acid;Keralyt;2-Hydroxybenzoic acid;o-Carboxyphenol;Salicylic acid (TN);Dr. Scholls Callus Removers;Salicylic acid (6CI,8CI);Verrugon;Ionil;Kyselina 2-hydroxybenzoova [Czech];CPD-110;Clear away Wart Remover;Saligel;salicylate;2-Carboxyphenol;Benzoic acid, 2-hydroxy- (9CI);Ionil Plus;Duoplant;benzoic acid, 2-hydroxy-;
EINECS: 200-712-3
Density: 1.376 g/cm3
Melting Point: 158-161 °C(lit.)
Boiling Point: 336.28 °C at 760 mmHg
Flash Point: 144.486 °C
Solubility: 1.8 g/L (20 °C) in water
Appearance: white crystalline powder
Hazard Symbols: HarmfulXn
Risk Codes: 22-41-36/37/38
Safety: 26-39-37/39-36
Transport Information: N/A
PSA: 57.53000
LogP: 1.09040
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  • 99%min Salicylic Acid CAS 69-72-7 For Pharmaceutical Intermediates

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Specification

Salicylic acid is a monohydroxybenzoic acid, a type of phenolic acid and a beta hydroxy acid. With the CAS NO. 69-72-7, This colorless crystalline organic acid is widely used in organic synthesis and functions as a plant hormone. It is derived from the metabolism of salicin.

Physical properties about Salicylic acid are: (1)ACD/LogP: 2.011; (2)ACD/LogD (pH 5.5): -0.92; (3)ACD/LogD (pH 7.4): -1.14; (4)ACD/BCF (pH 5.5): 1.00; (5)ACD/BCF (pH 7.4): 1.00; (6)ACD/KOC (pH 5.5): 1.00; (7)ACD/KOC (pH 7.4): 1.00; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.616; (12)Molar Refractivity: 35.064 cm3; (13)Molar Volume: 100.393 cm3; (14)Polarizability: 13.901 10-24cm3; (15)Surface Tension: 64.4169998168945 dyne/cm; (16)Density: 1.376 g/cm3; (17)Flash Point: 144.486 °C ; (18)Enthalpy of Vaporization: 61.157 kJ/mol; (19)Boiling Point: 336.28 °C at 760 mmHg

Preparation of Salicylic Acid: Salicylic acid is biosynthesized from the amino acid phenylalanine. In Arabidopsis thaliana it can also be synthesized via a phenylalanine-independent pathway.
Salicylic acid is commercially prepared by treating sodium phenolate (the sodium salt of phenol) with carbon dioxide at high pressure (100 atm) and high temperature (390K) -a method known as the Kolbe-Schmitt reaction. Acidification of the product with sulfuric acid gives salicylic acid:

Production of Salicylic acid

It can also be prepared by the hydrolysis of aspirin (acetylsalicylic acid) or methyl salicylate (oil of wintergreen) with a strong acid or base.

Uses of Salicylic Acid: Salicylic Acid is mainly applicated for the pharmaceutical industry especially in the manufacture of antipyretic, analgesic, anti-inflammatory, and diuretic drugs.It's also used in dyes industrial for azo direct dye and acidic mordant dyeing, and also for spices, etc.

When you are using this chemical, please be cautious about it as the following:
1. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice;
2.Wear eye/face protection;
3.Wear suitable gloves and eye/face protection;
4. Wear suitable protective clothing;

You can still convert the following datas into molecular structure:
(1)InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10);
(2) InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-N;
(3)Smilesc1(c(cccc1)O)C(=O)O;

The toxiciy data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 oral 400mg/kg (400mg/kg)   "Handbook of Toxicology," 4 vols., Philadelphia, W.B. Saunders Co., 1956-59Vol. 5, Pg. 148, 1959.
mammal (species unspecified) LC50 inhalation > 300mg/m3 (300mg/m3)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 57(7-8), Pg. 31, 1992.
man TDLo skin 57mg/kg (57mg/kg) SENSE ORGANS AND SPECIAL SENSES: TINNITUS: EAR JAMA, Journal of the American Medical Association. Vol. 244, Pg. 660, 1980.
mouse LD50 intraperitoneal 300mg/kg (300mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Gendai no Rinsho. Vol. 3, Pg. 675, 1969.
mouse LD50 intravenous 184mg/kg (184mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Yakugaku Zasshi. Journal of Pharmacy. Vol. 91, Pg. 550, 1971.
 
mouse LD50 oral 480mg/kg (480mg/kg)   "Handbook of Toxicology," 4 vols., Philadelphia, W.B. Saunders Co., 1956-59Vol. 5, Pg. 148, 1959.
mouse LD60 subcutaneous 520mg/kg (520mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

CARDIAC: CHANGE IN RATE
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 38, Pg. 9, 1930.
rabbit LD50 oral 1300mg/kg (1300mg/kg)   Drugs in Japan Vol. 6, Pg. 291, 1982.
rabbit LD50 skin > 10gm/kg (10000mg/kg)   BIOFAX Industrial Bio-Test Laboratories, Inc., Data Sheets. Vol. 21-3/1971,
rabbit LDLo subcutaneous 6gm/kg (6000mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1392, 1935.
rat LC50 inhalation > 900mg/m3/1H (900mg/m3)   BIOFAX Industrial Bio-Test Laboratories, Inc., Data Sheets. Vol. 21-3/1971,
rat LD50 intraperitoneal 157mg/kg (157mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 57(7-8), Pg. 31, 1992.
rat LD50 oral 891mg/kg (891mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
BIOFAX Industrial Bio-Test Laboratories, Inc., Data Sheets. Vol. 21-3/1971,
rat LD50 skin > 2gm/kg (2000mg/kg) LIVER: OTHER CHANGES

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 15(Suppl,
women TDLo skin 111mg/kg/10D- (111mg/kg)   Postgraduate Medical Journal. Vol. 70, Pg. 146, 1994.
 
women TDLo skin 111mg/kg/10D- (111mg/kg) CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP

SENSE ORGANS AND SPECIAL SENSES: CHANGE IN ACUITY: EAR
Postgraduate Medical Journal. Vol. 70, Pg. 146, 1994.
 

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