5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Modify Date: 2025-08-25 08:45:44

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure
5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid structure
Common Name 5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
CAS Number 66635-90-3 Molecular Weight 273.25900
Density N/A Boiling Point N/A
Molecular Formula C15H12FNO3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

 Chemical & Physical Properties

Molecular Formula C15H12FNO3
Molecular Weight 273.25900
Exact Mass 273.08000
PSA 59.30000
LogP 2.43010
InChIKey QLPSJIRLKUYLSZ-UHFFFAOYSA-N
SMILES O=C(c1ccc(F)cc1)c1ccc2n1CCC2C(=O)O

 Synthetic Route

~77%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Syntex (U.S.A.) Inc. Patent: US4347187 A1, 1982 ;

~61%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Muchowski; Unger; Ackrell; Cheung; Cooper; Cook; Gallegra; Halpern; Koehler; Kluge Journal of Medicinal Chemistry, 1985 , vol. 28, # 8 p. 1037 - 1049

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Muchowski; Unger; Ackrell; Cheung; Cooper; Cook; Gallegra; Halpern; Koehler; Kluge Journal of Medicinal Chemistry, 1985 , vol. 28, # 8 p. 1037 - 1049

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Muchowski; Unger; Ackrell; Cheung; Cooper; Cook; Gallegra; Halpern; Koehler; Kluge Journal of Medicinal Chemistry, 1985 , vol. 28, # 8 p. 1037 - 1049

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Franco, Fidencio; Greenhouse, Robert; Muchowski, Joseph M. Journal of Organic Chemistry, 1982 , vol. 47, # 9 p. 1682 - 1688

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Franco, Fidencio; Greenhouse, Robert; Muchowski, Joseph M. Journal of Organic Chemistry, 1982 , vol. 47, # 9 p. 1682 - 1688

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Franco, Fidencio; Greenhouse, Robert; Muchowski, Joseph M. Journal of Organic Chemistry, 1982 , vol. 47, # 9 p. 1682 - 1688

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Franco, Fidencio; Greenhouse, Robert; Muchowski, Joseph M. Journal of Organic Chemistry, 1982 , vol. 47, # 9 p. 1682 - 1688

~%

5-(4-fluorobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Structure

5-(4-fluorobenz...

CAS#:66635-90-3

Literature: Franco, Fidencio; Greenhouse, Robert; Muchowski, Joseph M. Journal of Organic Chemistry, 1982 , vol. 47, # 9 p. 1682 - 1688

 Bioassay

View more

Name: Minimum effective dose causing gastrointestinal erosion using seven-day chronic assay...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL785688
Name: Effective dose for rat paw assay
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL780547
Name: Antiinflammatory activity of compound determined by carrageenan rat paw edema assay
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL771049
Name: Analgesic activity of compound using carrageenan mouse phenylquinone writhing assay
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL728347
Name: Effective dose causing 50 % gastrointestinal erosion using seven-day chronic assay.
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL781220
Name: Effective dose for mouse writhing assay
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL736032
Name: Antiinflammatory activity using cotton pellet assay
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL771052
Name: Antiinflammatory activity using rat paw assay
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL771053
Name: Partition coefficient (logP) (HPLC)
Source: ChEMBL
Target: N/A
External Id: CHEMBL876041
Name: Dissociation constant (pKa)
Source: ChEMBL
Target: N/A
External Id: CHEMBL634299
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