4-Isopropylbenzoic acid supplier

Name
4-Isopropylbenzoic acid
EINECS 208-642-5
CAS No. 536-66-3
Article Data137
CAS DataBase
Density 1.08g/cm³
Solubility sparingly soluble in water
Melting Point 117-120 °C(lit.)
Formula C₁₀H₁₂O₂
Boiling Point 271.8 °C at 760 mmHg
Molecular Weight 164.204
Flash Point 128.1 °C
Transport Information
Appearance white crystalline powder
Safety 26-36/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xi, Xn
Synonyms Benzoicacid, p-isopropyl- (6CI,8CI);4-(1-Methylethyl)benzoic acid;4-Isopropylbenzoicacid;Cumic acid;Cuminic acid;p-Isopropylbenzoic acid;
PSA 37.30000
LogP 2.50820

4-Isopropylbenzoic acid Chemical Properties

Molecular Structure of 4-Isopropylbenzoic acid (CAS NO.536-66-3):

IUPAC Name: 4-propan-2-ylbenzoic acid
Empirical Formula: C₁₀H₁₂O₂
Molecular Weight: 164.2011
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 26.3 Å²
Index of Refraction: 1.535
Molar Refractivity: 47.36 cm³
Molar Volume: 152 cm³
Surface Tension: 40.8 dyne/cm
Density: 1.08 g/cm³
Flash Point: 128.1 °C
Enthalpy of Vaporization: 53.89 kJ/mol
Boiling Point: 271.8 °C at 760 mmHg
Vapour Pressure: 0.00308 mmHg at 25°C
EINECS: 208-642-5
Melting point: 117-120 °C(lit.)
Water Solubility: sparingly soluble
InChI
InChI=1/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)
Smiles
c1(C(C)C)ccc(C(O)=O)cc1
Product Categories: Acids and Derivatives; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Organic acids

4-Isopropylbenzoic acid Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD	intraperitoneal	> 500mg/kg (500mg/kg)		"Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 215, 1954.

4-Isopropylbenzoic acid Safety Profile

Hazard Codes: Irritant Xi, Harmful Xn
Risk Statements: 36/37/38-20/21/22
R36/37/38:Irritating to eyes, respiratory system and skin.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-36-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
WGK Germany: 3
RTECS: DH3850500

4-Isopropylbenzoic acid Specification

4-Isopropylbenzoic acid , with CAS number of 536-66-3, can be called 4-Isopropyl Benzoic Acid; Cuminic acid; 4-(1-Methylethyl)benzoic acid ; 4-(1-methylethyl)-benzoicaci; 4-(1-methylethyl)benzoicacid . It is a white crystalline powder. 4-Isopropylbenzoic acid (CAS NO.536-66-3) is used for pharmaceutical intermediates.

Product Name

4-Isopropylbenzoic acid

4-Isopropylbenzoic acid Chemical Properties

4-Isopropylbenzoic acid Toxicity Data With Reference

4-Isopropylbenzoic acid Safety Profile

4-Isopropylbenzoic acid Specification

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