2-Isopropylbenzoic acid supplier

Name
2-propan-2-ylbenzoic acid
EINECS
CAS No. 2438-04-2
Article Data21
CAS DataBase
Density 1.08g/cm³
Solubility
Melting Point 62-64 C
Formula C₁₀H₁₂O₂
Boiling Point 269.9°C at 760mmHg
Molecular Weight 164.204
Flash Point 127.3°C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzoicacid, o-isopropyl- (6CI,7CI,8CI);2-(1-Methylethyl)benzoic acid;2-Isopropylbenzoic acid;o-Isopropylbenzoic acid;
PSA 37.30000
LogP 2.50820

2-Isopropylbenzoic acid Specification

The 2-Isopropylbenzoic acid, with CAS registry number 2438-04-2, belongs to the following product categories: Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. Its systematic name and its IUPAC name are the same, which is 2-(propan-2-yl)benzoic acid. Besides this, it is also called Benzoic acid, 2-(1-methylethyl)-.

Preparation: this chemical can be prepared by 1-(2-isopropyl-phenyl)-ethanone. This reaction will need reagent Br₂, NaOH and solvent H₂O. The reaction time is 1 hour(s) with reaction temperature of 0 ℃. The yield is about 85%.

Uses of 2-Isopropylbenzoic acid: it can be used to produce 2-isopropyl-benzyl alcohol. This reaction will need reagent LiAlH₄ and solvent diethyl ether. The reaction time is 4 hour(s). The yield is about 99%.

When you are using this chemical, please be cautious about it as the following:
The 2-Isopropylbenzoic acid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccccc1C(C)C
(2)InChI: InChI=1/C10H12O2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7H,1-2H3,(H,11,12)
(3)InChIKey: BANZVKGLDQDFDV-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7H,1-2H3,(H,11,12)
(5)Std. InChIKey: BANZVKGLDQDFDV-UHFFFAOYSA-N

Product Name

2-propan-2-ylbenzoic acid

2-Isopropylbenzoic acid Specification

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