371-40-4,MFCD00007829
Catalog No.:AA0037VL

371-40-4 | 4-Fluoroaniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
99.93%
in stock  
$13.00   $9.00
- +
10g
99.93%
in stock  
$18.00   $12.00
- +
25g
99.93%
in stock  
$25.00   $17.00
- +
100g
99.93%
in stock  
$58.00   $40.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0037VL
Chemical Name:
4-Fluoroaniline
CAS Number:
371-40-4
Molecular Formula:
C6H6FN
Molecular Weight:
111.1169
MDL Number:
MFCD00007829
SMILES:
Nc1ccc(cc1)F
NSC Number:
579
UN Number:
2941
Properties
Computed Properties
 
Complexity:
66.9  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.1  

Literature

Title: Vibronic and cation spectroscopy of 2,4-difluoroaniline.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120701

Title: Imidazolopiperazines: lead optimization of the second-generation antimalarial agents.

Journal: Journal of medicinal chemistry 20120510

Title: 4-{(4Z)-4-[(2Z)-3-(4-Fluoro-anilino)-1-hy-droxy-but-2-en-1-yl-idene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: (2Z)-3-(4-Fluoro-anilino)-1-(5-hy-droxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)but-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: Targeting Mnks for cancer therapy.

Journal: Oncotarget 20120201

Title: Enzyme electrode for aromatic compounds exploiting the catalytic activities of microperoxidase-11.

Journal: Biosensors & bioelectronics 20111215

Title: Understanding of the mass spectrometric fragmentation pathways of a few potentially genotoxic haloaniline isomers in their protonated form by collision-induced dissociation.

Journal: Journal of pharmaceutical and biomedical analysis 20111205

Title: Bis(4-fluoro-anilinium) sulfate.

Journal: Acta crystallographica. Section E, Structure reports online 20110901

Title: meso-5,5'-Bis[(4-fluoro-phen-yl)diazen-yl]-2,2'-(pentane-3,3-di-yl)di-1H-pyrrole.

Journal: Acta crystallographica. Section E, Structure reports online 20110201

Title: Dichlorido(η-p-cymene)(4-fluoro-aniline-κN)ruthenium(II).

Journal: Acta crystallographica. Section E, Structure reports online 20110101

Title: 4-(4-Fluoro-anilino)-N-(4-fluoro-phen-yl)-3-nitro-benzamide.

Journal: Acta crystallographica. Section E, Structure reports online 20101101

Title: N-[(2-Chloro-3-quinol-yl)meth-yl]-4-fluoro-aniline.

Journal: Acta crystallographica. Section E, Structure reports online 20101001

Title: 4-Fluoro-anilinium tetra-chloridoferrate(III) 18-crown-6 clathrate.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: 4,5,6,7-Tetra-chloro-2-(4-fluoro-phen-yl)isoindoline-1,3-dione.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: Bis(4-fluoro-anilinium) tetra-chloridocuprate(II).

Journal: Acta crystallographica. Section E, Structure reports online 20100601

Title: Investigating the mechanisms of aromatic amine-induced protein free radical formation by quantitative structure-activity relationships: implications for drug-induced agranulocytosis.

Journal: Chemical research in toxicology 20100517

Title: Formation of a quinoneimine intermediate of 4-fluoro-N-methylaniline by FMO1: carbon oxidation plus defluorination.

Journal: Chemical research in toxicology 20100517

Title: N-(2-Fluoro-phen-yl)cinnamamide.

Journal: Acta crystallographica. Section E, Structure reports online 20100301

Title: 6-Fluoro-1,3,4-triphenyl-1H-pyrazolo[3,4-b]quinoline benzene hemisolvate.

Journal: Acta crystallographica. Section E, Structure reports online 20100301

Title: (E)-2-[(4-Fluoro-phen-yl)imino-meth-yl]-5-methoxy-phenol.

Journal: Acta crystallographica. Section E, Structure reports online 20100201

Title: Synthesis and Pharmacological Evaluation of Novel Schiff Base Analogues of 3-(4-amino) Phenylimino) 5-fluoroindolin-2-one.

Journal: Journal of young pharmacists : JYP 20100101

Title: 3,6-Dichloro-N-(4-fluoro-phen-yl)picolinamide.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Title: Phenyl N-(4-fluorophen-yl)carbamate.

Journal: Acta crystallographica. Section E, Structure reports online 20090501

Title: (E)-Ethyl 3-(4-fluoro-anilino)-2-(4-methoxy-phen-yl)acrylate.

Journal: Acta crystallographica. Section E, Structure reports online 20081201

Title: 2-Bromo-4-chloro-6-(4-fluoro-phenyl-imino-meth-yl)phenol.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: Theoretical Raman and infrared spectra, and vibrational assignment for para-halogenoanilines: DFT study.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20071101

Title: Synthesis and antitumor activity of some novel quinazoline derivatives bearing the biologically active thione moiety.

Journal: Arzneimittel-Forschung 20060101

Title: N-acylanilines, herbicide-CHA chimera, and amino acid analogues as novel chemical hybridizing agents for wheat (Triticum aestivum L.).

Journal: Journal of agricultural and food chemistry 20051005

Title: Schiff bases of gossypol: an NMR and DFT study.

Journal: Magnetic resonance in chemistry : MRC 20050401

Title: Convenient access both to highly antimalaria-active 10-arylaminoartemisinins, and to 10-alkyl ethers including artemether, arteether, and artelinate.

Journal: Chembiochem : a European journal of chemical biology 20050401

Title: Hydrogen bonding in 1:1 proton-transfer compounds of 5-sulfosalicylic acid with 4-X-substituted anilines (X = F, Cl or Br).

Journal: Acta crystallographica. Section C, Crystal structure communications 20050201

Title: Potential of neurotoxicity after a single oral dose of 4-bromo-, 4-chloro-, 4-fluoro- or 4-iodoaniline in rats.

Journal: Journal of applied toxicology : JAT 20030101

Title: Metabolism of 4-fluoroaniline and 4-fluorobiphenyl in the earthworm Eisenia veneta characterized by high-resolution NMR spectroscopy with directly coupled HPLC-NMR and HPLC-MS.

Journal: Xenobiotica; the fate of foreign compounds in biological systems 20020601

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SDS
Tags:371-40-4 Molecular Formula|371-40-4 MDL|371-40-4 SMILES|371-40-4 4-Fluoroaniline
Catalog No.: AA0037VL
371-40-4,MFCD00007829
371-40-4 | 4-Fluoroaniline
Pack Size: 5g
Purity: 99.93%
in stock
$13.00 $9.00
Pack Size: 10g
Purity: 99.93%
in stock
$18.00 $12.00
Pack Size: 25g
Purity: 99.93%
in stock
$25.00 $17.00
Pack Size: 100g
Purity: 99.93%
in stock
$58.00 $40.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0037VL
Chemical Name: 4-Fluoroaniline
CAS Number: 371-40-4
Molecular Formula: C6H6FN
Molecular Weight: 111.1169
MDL Number: MFCD00007829
SMILES: Nc1ccc(cc1)F
NSC Number: 579
UN Number: 2941
Properties
Complexity: 66.9  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.1  
Literature fold

Title: Vibronic and cation spectroscopy of 2,4-difluoroaniline.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy20120701

Title: Imidazolopiperazines: lead optimization of the second-generation antimalarial agents.

Journal: Journal of medicinal chemistry20120510

Title: 4-{(4Z)-4-[(2Z)-3-(4-Fluoro-anilino)-1-hy-droxy-but-2-en-1-yl-idene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online20120301

Title: (2Z)-3-(4-Fluoro-anilino)-1-(5-hy-droxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)but-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online20120301

Title: Targeting Mnks for cancer therapy.

Journal: Oncotarget20120201

Title: Enzyme electrode for aromatic compounds exploiting the catalytic activities of microperoxidase-11.

Journal: Biosensors & bioelectronics20111215

Title: Understanding of the mass spectrometric fragmentation pathways of a few potentially genotoxic haloaniline isomers in their protonated form by collision-induced dissociation.

Journal: Journal of pharmaceutical and biomedical analysis20111205

Title: Bis(4-fluoro-anilinium) sulfate.

Journal: Acta crystallographica. Section E, Structure reports online20110901

Title: meso-5,5'-Bis[(4-fluoro-phen-yl)diazen-yl]-2,2'-(pentane-3,3-di-yl)di-1H-pyrrole.

Journal: Acta crystallographica. Section E, Structure reports online20110201

Title: Dichlorido(η-p-cymene)(4-fluoro-aniline-κN)ruthenium(II).

Journal: Acta crystallographica. Section E, Structure reports online20110101

Title: 4-(4-Fluoro-anilino)-N-(4-fluoro-phen-yl)-3-nitro-benzamide.

Journal: Acta crystallographica. Section E, Structure reports online20101101

Title: N-[(2-Chloro-3-quinol-yl)meth-yl]-4-fluoro-aniline.

Journal: Acta crystallographica. Section E, Structure reports online20101001

Title: 4-Fluoro-anilinium tetra-chloridoferrate(III) 18-crown-6 clathrate.

Journal: Acta crystallographica. Section E, Structure reports online20100701

Title: 4,5,6,7-Tetra-chloro-2-(4-fluoro-phen-yl)isoindoline-1,3-dione.

Journal: Acta crystallographica. Section E, Structure reports online20100701

Title: Bis(4-fluoro-anilinium) tetra-chloridocuprate(II).

Journal: Acta crystallographica. Section E, Structure reports online20100601

Title: Investigating the mechanisms of aromatic amine-induced protein free radical formation by quantitative structure-activity relationships: implications for drug-induced agranulocytosis.

Journal: Chemical research in toxicology20100517

Title: Formation of a quinoneimine intermediate of 4-fluoro-N-methylaniline by FMO1: carbon oxidation plus defluorination.

Journal: Chemical research in toxicology20100517

Title: N-(2-Fluoro-phen-yl)cinnamamide.

Journal: Acta crystallographica. Section E, Structure reports online20100301

Title: 6-Fluoro-1,3,4-triphenyl-1H-pyrazolo[3,4-b]quinoline benzene hemisolvate.

Journal: Acta crystallographica. Section E, Structure reports online20100301

Title: (E)-2-[(4-Fluoro-phen-yl)imino-meth-yl]-5-methoxy-phenol.

Journal: Acta crystallographica. Section E, Structure reports online20100201

Title: Synthesis and Pharmacological Evaluation of Novel Schiff Base Analogues of 3-(4-amino) Phenylimino) 5-fluoroindolin-2-one.

Journal: Journal of young pharmacists : JYP20100101

Title: 3,6-Dichloro-N-(4-fluoro-phen-yl)picolinamide.

Journal: Acta crystallographica. Section E, Structure reports online20090801

Title: Phenyl N-(4-fluorophen-yl)carbamate.

Journal: Acta crystallographica. Section E, Structure reports online20090501

Title: (E)-Ethyl 3-(4-fluoro-anilino)-2-(4-methoxy-phen-yl)acrylate.

Journal: Acta crystallographica. Section E, Structure reports online20081201

Title: 2-Bromo-4-chloro-6-(4-fluoro-phenyl-imino-meth-yl)phenol.

Journal: Acta crystallographica. Section E, Structure reports online20080701

Title: Theoretical Raman and infrared spectra, and vibrational assignment for para-halogenoanilines: DFT study.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy20071101

Title: Synthesis and antitumor activity of some novel quinazoline derivatives bearing the biologically active thione moiety.

Journal: Arzneimittel-Forschung20060101

Title: N-acylanilines, herbicide-CHA chimera, and amino acid analogues as novel chemical hybridizing agents for wheat (Triticum aestivum L.).

Journal: Journal of agricultural and food chemistry20051005

Title: Schiff bases of gossypol: an NMR and DFT study.

Journal: Magnetic resonance in chemistry : MRC20050401

Title: Convenient access both to highly antimalaria-active 10-arylaminoartemisinins, and to 10-alkyl ethers including artemether, arteether, and artelinate.

Journal: Chembiochem : a European journal of chemical biology20050401

Title: Hydrogen bonding in 1:1 proton-transfer compounds of 5-sulfosalicylic acid with 4-X-substituted anilines (X = F, Cl or Br).

Journal: Acta crystallographica. Section C, Crystal structure communications20050201

Title: Potential of neurotoxicity after a single oral dose of 4-bromo-, 4-chloro-, 4-fluoro- or 4-iodoaniline in rats.

Journal: Journal of applied toxicology : JAT20030101

Title: Metabolism of 4-fluoroaniline and 4-fluorobiphenyl in the earthworm Eisenia veneta characterized by high-resolution NMR spectroscopy with directly coupled HPLC-NMR and HPLC-MS.

Journal: Xenobiotica; the fate of foreign compounds in biological systems20020601

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