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4-Isopropylbenzoic acid

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4-Isopropylbenzoic acid Basic information

Product Name:
4-Isopropylbenzoic acid
Synonyms:
  • RARECHEM AL BO 0601
  • P-ISO-PROPYLBENZOIC ACID
  • 4-(1-Methylethyl)benzoic acid
  • 4-(1-methylethyl)-benzoicaci
  • 4-(1-methylethyl)benzoicacid
  • Benzoic acid, p-isopropyl-
  • p-isopropyl-benzoicaci
  • 4-isopropyl benzioc acid
CAS:
536-66-3
MF:
C10H12O2
MW:
164.2
EINECS:
208-642-5
Product Categories:
  • Building Blocks
  • C10
  • Carbonyl Compounds
  • Carboxylic Acids
  • Chemical Synthesis
  • Organic Building Blocks
  • Acids and Derivatives
  • Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts
  • Organic acids
Mol File:
536-66-3.mol
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4-Isopropylbenzoic acid Chemical Properties

Melting point:
117-120 °C (lit.)
Boiling point:
271.8°C
Density 
d4 1.162
refractive index 
1.5198 (estimate)
storage temp. 
Inert atmosphere,Room Temperature
solubility 
alcohol: soluble(lit.)
form 
Crystalline Powder
pka
4.35±0.10(Predicted)
color 
White
Water Solubility 
sparingly soluble
Merck 
14,2618
InChIKey
CKMXAIVXVKGGFM-UHFFFAOYSA-N
CAS DataBase Reference
536-66-3(CAS DataBase Reference)
NIST Chemistry Reference
Benzoic acid, 4-(1-methylethyl)-(536-66-3)
EPA Substance Registry System
4-Isopropylbenzoic acid (536-66-3)
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Safety Information

Hazard Codes 
Xi,Xn
Risk Statements 
36/37/38-20/21/22
Safety Statements 
26-36-36/37/39
WGK Germany 
3
RTECS 
DH3850500
TSCA 
Yes
HS Code 
29163990

MSDS

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4-Isopropylbenzoic acid Usage And Synthesis

Chemical Properties

white crystalline powder

Uses

4-Isopropylbenzoic acid (cuminic acid) was used in the synthesis of three new triorganotin carboxylates bearing methyl, butyl and phenyl substituents at tin, respectively. The products were fully characterized by spectroscopic and thermal techniques, with regard to the coordination number of tin atom, in solution and in the solid state.

Definition

ChEBI: A cumic acid that consists of benzoic acid substituted by an isopropyl group at position 4.

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