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2-(4-Bromomethyl)phenylpropionic acid

2-(4-Bromomethyl)phenylpropionic acid Structure
CAS No.
111128-12-2
Chemical Name:
2-(4-Bromomethyl)phenylpropionic acid
Synonyms
BMPPA;2-[4-(BROMOMETHYL)PHENYL]PROPIONIC ACID;2-[4-(BROMOMETHYL)PHENYL]PROPANOIC ACID;Loxoprofen 16;Loxoprofen Impurity 28;Loxoprofen Intermediate;p-Bromomethyl isocyanate;Loxoprofen Sodium intermediate;4-(BROMOMETHYL)HYDRATROPIC ACID;2-[4-(Xiu Jiaji)phenyl]propionate
CBNumber:
CB3420139
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.1
MOL File:
111128-12-2.mol
MSDS File:
SDS
Modify Date:
2024/7/24 17:31:20

2-(4-Bromomethyl)phenylpropionic acid Properties

Melting point 126-130 °C(lit.)
Boiling point 148°C (rough estimate)
Density 1.4557 (rough estimate)
refractive index 1.5220 (estimate)
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility Chloroform (Slightly), Methanol (Slightly)
pka 4.29±0.10(Predicted)
form powder to crystal
color White to Light yellow to Light orange
InChI InChI=1S/C10H11BrO2/c1-7(10(12)13)9-4-2-8(6-11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)
InChIKey QQXBRVQJMKBAOZ-UHFFFAOYSA-N
SMILES C(O)(=O)C(C1=CC=C(CBr)C=C1)C
CAS DataBase Reference 111128-12-2(CAS DataBase Reference)

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS05
Signal word  Danger
Hazard statements  H314
Precautionary statements  P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
Hazard Codes  C,Xi
Risk Statements  34-36/37/38
Safety Statements  26-27-36/37/39-45-37/39
RIDADR  UN 1759 8/PG 2
WGK Germany  3
HazardClass  8
PackingGroup 
HS Code  29163990
NFPA 704
0
2 0

2-(4-Bromomethyl)phenylpropionic acid price More Price(4)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 530360 2-[4-(Bromomethyl)phenyl]propionic acid 96% 111128-12-2 25G ₹38114.83 2022-06-14 Buy
Sigma-Aldrich(India) 530360 2-[4-(Bromomethyl)phenyl]propionic acid 96% 111128-12-2 25G ₹38114.83 2022-06-14 Buy
TCI Chemicals (India) B2101 2-[4-(Bromomethyl)phenyl]propionic Acid 111128-12-2 5G ₹6300 2022-05-26 Buy
TCI Chemicals (India) B2101 2-[4-(Bromomethyl)phenyl]propionic Acid 111128-12-2 25G ₹19500 2022-05-26 Buy
Product number Packaging Price Buy
530360 25G ₹38114.83 Buy
530360 25G ₹38114.83 Buy
B2101 5G ₹6300 Buy
B2101 25G ₹19500 Buy

2-(4-Bromomethyl)phenylpropionic acid Chemical Properties,Uses,Production

Chemical Properties

beige-cream crystalline powder

General Description

2-[4-(Bromomethyl)phenyl]propionic acid is a propionic acid derivative. Its enthalpy of vaporization at boiling point (421.15K) is 36.363kjoule/mol and density at 25°C is 1.4212g/ml.

Synthesis

The synthesis method comprises the following steps: dissolving sodium hydroxide in excessive methanol to react with p-chloro-tolualdehyde to obtain p-methoxy-tolualdehyde, andthen performing chloromethylation reaction on the p-methoxy tolualdehyde and concentrated hydrochloric acid in the existence of sulfuric acid to obtain p-chloromethyl benzyl ether; performing nucleophilic reaction on the p-chloromethyl benzyl ether and the sodium cyanide to obtain p-methoxy-methyl benzyl cyanide; reacting the p-methoxy-methyl benzyl cyanide with dimethyl carbonate under high pressure in the existence of a catalyst to obtain p-methoxy-methyl benzyl iso-propionitrile; and reacting the p-methoxy-methylbenzyl sodium isopropionate with excessive concentrate sulfuric acid to generate molten salt which is reacted with hydrobromic acid to obtain 2-(4-Bromomethyl)phenylpropionic acid.

2-(4-Bromomethyl)phenylpropionic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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4-(BROMOMETHYL)HYDRATROPIC ACID 2-[(P-BROMOMETHYL)PHENYL]PROPIONIC ACID 2-[4-(Bromomethyl)phenyl]propinic acid Loxoprofen Intermediate 2-(4-bromomethylphenyl)propionic acid (intermediate of loxoprofen) 2-[4-(bromomethyl)phenyl]propanoic acid (intermediate of loxoprofen) 2-(4-BROMOMETHYL)PHENYLPROPIONIC ACID 97% 2-(4-Bromomethyl)phenylpropionic acid,97% 2-[p-(Bromomethyl)phenyl]propanoic acid 2-((4-Bromomethyl)phenyl)propanic acid 2-(4-BroMoMethyl)phenylpropionic acid, 97% 5GR 2-(4-BoroMoMethyl phenyl)propionic Acid 2-[4-(Bromomethyl)phenyl]propionic acid, 4-(1-Carboxyethyl)benzyl bromide 3-(2-(broMoMethyl)phenyl)propanoic acid 2-[4-(Xiu Jiaji)phenyl]propionate Loxoprofen Impurity 28 (2R)-2-[4-(bromomethyl)phenyl]propanoate 2-[4-(Bromomethyl)phenyl]propionic Acid > Benzeneacetic acid, 4-(bromomethyl)-α-methyl- 2- ( 4-Bromomethyl )c phenylpropionic acid p-Bromomethyl isocyanate 2-[4-(BROMOMETHYL)PHENYL]PROPANOIC ACID 2-[4-(BROMOMETHYL)PHENYL]PROPIONIC ACID BMPPA 2-(4-Bromomethyl)phenylpropionic acid Synonyms Benzeneacetic acid, 4-(bromomethyl)-α-methyl- Loxoprofen Sodium intermediate Loxoprofen 16 111128-12-2 11128-12-2 C10H11BrO2 BrCH2C6H4CHCH3CO2H C10H10BrO2 Building Blocks C10 Carbonyl Compounds Carboxylic Acids Organic Building Blocks Pharmaceutical intermediate Organic acids (intermediate of loxoprofen) C10 Carbonyl Compounds Carboxylic Acids Aromatic Propionic Acids