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Home Other Building Blocks 4-Fluorophenethylamine

4-Fluorophenethylamine

CAS No.:
1583-88-6
Catalog Number:
AG001Q4I
Molecular Formula:
C8H10FN
Molecular Weight:
139.1701
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG001Q4I
Chemical Name:
4-Fluorophenethylamine
CAS Number:
1583-88-6
Molecular Formula:
C8H10FN
Molecular Weight:
139.1701
MDL Number:
MFCD00134208
IUPAC Name:
2-(4-fluorophenyl)ethanamine
InChI:
InChI=1S/C8H10FN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2
InChI Key:
CKLFJWXRWIQYOC-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)F
EC Number:
216-435-6
Properties
Complexity:
87.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.08g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.173g/mol
Monoisotopic Mass:
139.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
6-(4-Fluoro-pheneth-yl)-7-imino-3-phenyl-2,3,6,7-tetra-hydro-1,3-thia-zolo[4,5-d]pyrimidine-2-thione. Acta crystallographica. Section E, Structure reports online 20091201
Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1. Bioorganic & medicinal chemistry 20080801
New efficient substrates for semicarbazide-sensitive amine oxidase/VAP-1 enzyme: analysis by SARs and computational docking. Journal of medicinal chemistry 20061019
Regioselective enzyme-catalyzed synthesis of sophorolipid esters, amides, and multifunctional monomers. The Journal of organic chemistry 20030711
Properties