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3-(4-FLUOROBENZOYL)PROPIONIC ACID

CAS No.
366-77-8
Chemical Name:
3-(4-FLUOROBENZOYL)PROPIONIC ACID
Synonyms
4-(4-FLUOROPHENYL)-4-OXOBUTANOIC ACID;R 11302;AKOS BBS-00006441;LABOTEST-BB LT00233221;HALOPERIDOL METABOLITE III;3-(4-FLUOROBENZOYL)PROPIONIC ACID;4-Fluoro-oxo-benzenebutanoic acid;4-Fluoro-γ-oxobenzenebutyric acid;β-(p-Fluorobenzoyl)propionic acid;3-(4-Fluorobenzoyl)propanoic acid
CBNumber:
CB9412884
Molecular Formula:
C10H9FO3
Molecular Weight:
196.18
MDL Number:
MFCD00002793
MOL File:
366-77-8.mol
MSDS File:
SDS
TDS File:
TDS
Last updated:2026-05-28 06:19:41
Product description Number Pack Size Price
3-(4-Fluorobenzoyl)propionic Acid >97.0%(GC)(T) F0379 5g $87
3-(4-Fluorobenzoyl)propionic Acid >97.0%(GC)(T) F0379 25g $302
3-(4-Fluorobenzoyl)propionic acid Asreported 276078 500g $878
3-(4-Fluorobenzoyl)propionic acid Asreported 276078 1kg $1391
3-(4-Fluorobenzoyl)propionic acid Asreported 276078 2kg $2380
More product size

3-(4-FLUOROBENZOYL)PROPIONIC ACID Properties

Melting point 100-102 °C (lit.)
Boiling point 374.4±22.0 °C(Predicted)
Density 1.2441 (estimate)
storage temp. Sealed in dry,Room Temperature
solubility Chloroform (Slightly), Methanol (Slightly)
form powder to crystal
pka 4.50±0.17(Predicted)
color White to Orange to Green
Water Solubility Insoluble in water.
BRN 958145
InChI 1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)
InChIKey WUYWHIAAQYQKPP-UHFFFAOYSA-N
SMILES OC(=O)CCC(=O)c1ccc(F)cc1
CAS DataBase Reference 366-77-8(CAS DataBase Reference)
FDA UNII V2Z6N6JC9Z
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H335-H315-H319-H302
Precautionary statements  P280g-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
PPE dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes  Xn,C,Xi
Risk Statements  36/37/38-20/21/22-22
Safety Statements  36/37/39-26-22-24/25
WGK Germany  3
Hazard Note  Corrosive
HazardClass  IRRITANT
HS Code  29183000
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704
0
2 0

3-(4-FLUOROBENZOYL)PROPIONIC ACID price More Price(61)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TCI Chemical F0379 3-(4-Fluorobenzoyl)propionic Acid >97.0%(GC)(T) 366-77-8 5g $87 2026-04-30 Buy
TCI Chemical F0379 3-(4-Fluorobenzoyl)propionic Acid >97.0%(GC)(T) 366-77-8 25g $302 2026-04-30 Buy
Usbiological 276078 3-(4-Fluorobenzoyl)propionic acid Asreported 366-77-8 500g $878 2026-06-03 Buy
Usbiological 276078 3-(4-Fluorobenzoyl)propionic acid Asreported 366-77-8 1kg $1391 2026-06-03 Buy
Usbiological 276078 3-(4-Fluorobenzoyl)propionic acid Asreported 366-77-8 2kg $2380 2026-06-03 Buy
Product number Packaging Price Buy
F0379 5g $87 Buy
F0379 25g $302 Buy
276078 500g $878 Buy
276078 1kg $1391 Buy
276078 2kg $2380 Buy

3-(4-FLUOROBENZOYL)PROPIONIC ACID Chemical Properties,Uses,Production

Chemical Properties

beige granular powder

Uses

7-Fluoro-1-tetralone was prepared from 3-(4-fluorobenzoyl)-propionic acid by Wolff-Kishner reduction followed by ring closure with polyphosphoric acid and other substituted 1-tetralones where commercially available. Reduction of 3-(4-fluorobenzoyl)propionic acid with an excess of tert-butylamine borane (TBAB) in the presence of AlCl3 provided 4-(4-fluorophenyl)-1-butanol (87) in 63% yield for the synthesis of LM-1507 sodium salt. Penfluridol 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-chloro-3-trifluoromethylphenyl)- 4-hydroxypiperidine, C 28 H 27 ClF 5 NO, M r 523.99, mp 105 - 107°C, is obtained by reducing the ketone of 3-(4-fluorobenzoyl)propionic acid into a lactone.

Definition

ChEBI: 4-(4-Fluorophenyl)-4-oxobutanoic acid is an aromatic ketone.

General Description

3-(4-Fluorobenzoyl)propionic acid is a metabolite of haloperidol, a dopamine D2 receptor blocker.

Synthesis

Succinic anhydride

108-30-5

Fluorobenzene

462-06-6

3-(4-FLUOROBENZOYL)PROPIONIC ACID

366-77-8

1. aluminum chloride (2.66 g, 20 mmol) was slowly added to a stirred mixture of succinic anhydride (1.00 g, 10 mmol) and fluorobenzene (5.6 mL, 60 mmol) at -5 °C. 2. the reaction temperature was maintained at -5 °C for 1 hour, followed by a slow warming to room temperature, and the reaction continued for 17 hours. 3. the reaction mixture was slowly poured into a stirred 18% HCl aqueous solution (30 mL) at 0 °C and stirring was continued for 30 min while the mixture was allowed to gradually warm up to room temperature. 4. The resulting white powder was collected by filtration and washed with deionized water. 5. The product was 4-(4-(4-hydroxyphenyl)ethyl)ethyl). 5. The product was 4-(4-fluorophenyl)-4-oxobutyric acid in 1.67 g, 85% yield. 6. ; HPLC tR = 1.53 min (>99% purity, mobile phase is an aqueous solution of 80% MeCN).

References

[1] Helvetica Chimica Acta, 1995, vol. 78, # 3, p. 647 - 662
[2] Patent: WO2007/96647, 2007, A2. Location in patent: Page/Page column 148-149
[3] Patent: CN107556287, 2018, A. Location in patent: Paragraph 0036; 0037; 0038; 0039; 0040; 0052; 0053
[4] Patent: CN106187863, 2016, A. Location in patent: Paragraph 0153; 0154; 0155; 0156; 0157; 0104-0108
[5] Tetrahedron Letters, 2016, vol. 57, # 24, p. 2583 - 2586

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View Lastest Price from 3-(4-FLUOROBENZOYL)PROPIONIC ACID manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
3-(4-FLUOROBENZOYL)PROPIONIC ACID pictures 2019-12-31 3-(4-FLUOROBENZOYL)PROPIONIC ACID
366-77-8
$1.00 1KG 99% 200kg Career Henan Chemical Co
HALOPERIDOL METABOLITE III LABOTEST-BB LT00233221 3-(4'-FLUOROBENZOYL)PROPIONIC ACID 3-(4-FLUOROBENZOYL)PROPIONIC ACID 4-(4-FLUOROPHENYL)-4-OXOBUTYRIC ACID AKOS BBS-00006441 4-FLUORO-R-OXO-BENZENEBUTANOIC ACID Benzenebutanoic acid, 4-fluoro-.gamma.-oxo- 3-(4-Fluorobenzoyl)propionic acid 97% 3-(4-Fluorobenzoyl)propionicacid97% beta-(4-fluorobenzoyl)propionic acid 4-Fluoro-oxo-benzenebutanoic acid R 11302 Haloperidol metabolite III, R 11302 4-Fluoro-γ-oxobenzenebutyric acid 4-Oxo-4-(4-fluorophenyl)butyric acid β-(p-Fluorobenzoyl)propionic acid 3-(4-Fluorobenzoyl)propanoic acid 97% 3-(4-Fluorobenzoyl)propionic acid, 98%+ 3-(4-Fluorobenzoyl)propanoic acid 3-(p-Fluorobenzoyl)-propionic acid 4-(4-fluorophenyl)-4-keto-butyric acid 3-(4-Fluorobenzoyl)propionic Acid 3-(4- 4-(4-Fluorophenyl)-4-oxobutanoic acid 97% 4-(4-fluorophenyl)-4-oxobutanoate 3-(4-Fluorobenzoyl)propionicAcid> Benzenebutanoic acid, 4-fluoro-γ-oxo- 3-(4-Fluorobenzoyl)-propionic acid, 1mg/ml in Methanol 4-(4-FLUOROPHENYL)-4-OXOBUTANOIC ACID 366-77-8 FC6H4COCH2CH2CO2H CARBOXYLIC ACID Building Blocks C10 Carboxylic Acids Carbonyl Compounds Organic Building Blocks Aromatic Building Blocks Aromatic Propionic Acids Acids & Esters Fluorine Compounds