Home Fluorides 366-77-8
366-77-8,MFCD00002793
Catalog No.:AA003I1J
366-77-8 | 3-(4-Fluorobenzoyl)propionic acid
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1g
95%
in stock  
$15.00   $10.00
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5g
95%
in stock  
$36.00   $25.00
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25g
95%
in stock  
$86.00   $60.00
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100g
95%
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$258.00   $180.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003I1J
Chemical Name:
3-(4-Fluorobenzoyl)propionic acid
CAS Number:
366-77-8
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
MDL Number:
MFCD00002793
IUPAC Name:
4-(4-fluorophenyl)-4-oxobutanoic acid
InChI:
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)
InChI Key:
WUYWHIAAQYQKPP-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)F)CCC(=O)O
EC Number:
206-679-1
UNII:
V2Z6N6JC9Z
NSC Number:
408180
Properties
Computed Properties
 
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.054g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.177g/mol
Monoisotopic Mass:
196.054g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
(18F)-beta-(4-fluorobenzoyl)propionic acid 
4-FBPA 
Haloperidol metabolite III 
C10-H9-F-O3 
AR-1L8610 
CID101359 
3-(4-Fluorobenzoyl)propionic acid, 98% 5g 
3-(4-Fluorobenzoyl)propionic acid, 97% - 25G 25g 
3819-18-9 
4-(4-Fluorophenyl)-4-oxobutyric acid 
V2Z6N6JC9Z 
3-(p-fluorobenzoyl)propionic acid 
WUYWHIAAQYQKPP-UHFFFAOYSA-N 
3-(p-Fluorobenzoyl)-propionic acid 
MFCD00002793 
4-(4-fluorophenyl)-4-oxo-butanoic acid 
4-(4-FLUORO-PHENYL)-4-OXO-BUTYRIC ACID 
R 11302 
beta-(4-fluorobenzoyl)propionic acid 
Maybridge1_000099 
EINECS 206-679-1 
NSC 408180 
PubChem3484 
ACMC-209iny 
Benzenebutanoic acid, 4-fluoro-.gamma.-oxo- 
AC1L2QO7 
MixCom1_000187 
KSC223Q6T 
SCHEMBL315309 
3-(4-Fluorobenzoyl)propionic acid 
AC1Q5E78 
AC1Q754S 
Jsp006519 
CHEMBL3544869 
CTK1C3869 
KS-00000CLI 
TIMTEC-BB SBB042480 
DTXSID30190084 
3-(4-Fluorobenzoyl)propionicAcid 
OTAVA-BB 1043517 
366-77-8 
ZINC128838 
3-(4-Fluorobenzoyl]propionic?acid 
beta-p-fluorobenzoyl-propionic acid 
ALBB-005979 
BCP22268 
3-(4-fluorobenzoyl)-propionic acid 
AKOS BBS-00006441 
AB3821 
ANW-28460 
BBL008682 
4-(4-Fluorophenyl)-4-oxobutanoic acid 
CCG-47698 
NSC408180 
SBB042480 
STK503651 
4-fluoro-gamma-oxobenzenebutanoic acid 
AKOS000119372 
AB00270 
AS01281 
BS-4084 
CS-W010603 
UNII-V2Z6N6JC9Z 
MCULE-5194103569 
NSC-408180 
TRA0014368 
VZ26014 
NCGC00342071-01 
3-(4-Fluorobenzoyl)propionic acid, 97% 
AJ-12030 
AK-46792 
AN-21861 
AN-44553 
3-(4-Fluorobenzoyl)propanoic acid 
BR-46792 
L569 
SY008025 
4-(4-Fluorophenyl)-4-oxobutanoic acid # 
Benzenebutanoic acid, 4-fluoro-gamma-oxo- 
3-(4'-FLUOROBENZOYL)PROPIONIC ACID 
AB0014778 
DB-021657 
ST2410360 
TL8002700 
3-(4-Fluorobenzoyl) propionic acid 
TR-014983 
AM20061180 
EU-0099945 
F0379 
FT-0613662 
ST50114953 
AZ0001-0152 
C-4787 
AB01314400-03 
MFCD00002793 (97+%) 
beta-(4-Fluorobenzoyl)propionic acid 
SR-01000597214 
I01-2088 
SR-01000597214-1 
SR-01000597214-2 
W-106599 
Z57984615 
5-[5-(azepan-1-ylcarbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(5-methyl-2-furyl)methyl]-1H-pyrrole-3-sulfonamide 
C10H9FO3 
3-(4-Fluorobenzoyl]propionic 
|A-(4-fluorobenzoyl)propionic acid 
Literature

Title: Structure-activity relationship of butyrate analogues on apoptosis, proliferation and histone deacetylase activity in HCT-116 human colorectal cancer cells.

Journal: Clinical and experimental pharmacology & physiology 20100901

Title: [Chemical toxicological analysis of haloperidol metabolite 4-(4-chlorophenyl)-4-hydroxypipiridine in urine by high-performance liquid chromatography].

Journal: Sudebno-meditsinskaia ekspertiza 20090101

Title: Identification of a new functional target of haloperidol metabolite: implications for a receptor-independent role of 3-(4-fluorobenzoyl) propionic acid.

Journal: Journal of neurochemistry 20061001

Title: Simultaneous analysis of haloperidol, its three metabolites and two other butyrophenone-type neuroleptics by high performance liquid chromatography with dual ultraviolet detection.

Journal: Biomedical chromatography : BMC 20060201

Title: Uptake of 6-[18F]fluoro-L-dopa and [18F]CFT reflect nigral neuronal loss in a rat model of Parkinson's disease.

Journal: Synapse (New York, N.Y.) 20040201

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