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Home Other Building Blocks 4-Fluorophenethyl alcohol

4-Fluorophenethyl alcohol

CAS No.:
7589-27-7
Catalog Number:
AG003EWC
Molecular Formula:
C8H9FO
Molecular Weight:
140.1549
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$18
- +
25g
97%
In Stock USA
United States
$58
- +
100g
97%
In Stock USA
United States
$144
- +
500g
97%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG003EWC
Chemical Name:
4-Fluorophenethyl alcohol
CAS Number:
7589-27-7
Molecular Formula:
C8H9FO
Molecular Weight:
140.1549
MDL Number:
MFCD00002898
IUPAC Name:
2-(4-fluorophenyl)ethanol
InChI:
InChI=1S/C8H9FO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2
InChI Key:
MWUVGXCUHWKQJE-UHFFFAOYSA-N
SMILES:
OCCc1ccc(cc1)F
EC Number:
231-499-5
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:
140.064g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.157g/mol
Monoisotopic Mass:
140.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Chiral recognition between 1-(4-fluorophenyl)ethanol and 2-butanol: higher binding energy of homochiral complexes in the gas phase. Physical chemistry chemical physics : PCCP 20110121
Water binding sites in 2-para- and 2-ortho-fluorophenylethanol: a high-resolution UV experiment and ab initio calculations. The Journal of chemical physics 20101121
Mass analysed threshold ionisation spectroscopy of flexible 2-para-fluorophenylethanol conformers with and without an intramolecular OH...pi bond. Physical chemistry chemical physics : PCCP 20090407
Fluorine substitution and nonconventional OH...pi intramolecular bond: high-resolution UV spectroscopy and ab initio calculations of 2-(p-fluorophenyl)ethanol. Physical chemistry chemical physics : PCCP 20080521
Synthesis and application of mono-6-(3-methylimidazolium)-6-deoxyperphenylcarbamoyl-beta-cyclodextrin chloride as chiral stationary phases for high-performance liquid chromatography and supercritical fluid chromatography. Journal of chromatography. A 20080222
Properties