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2-Fluoroethanol

CAS No.:
371-62-0
Catalog Number:
AG003HBU
Molecular Formula:
C2H5FO
Molecular Weight:
64.0589
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Product Description
Catalog Number:
AG003HBU
Chemical Name:
2-Fluoroethanol
CAS Number:
371-62-0
Molecular Formula:
C2H5FO
Molecular Weight:
64.0589
MDL Number:
MFCD00002828
IUPAC Name:
2-fluoroethanol
InChI:
InChI=1S/C2H5FO/c3-1-2-4/h4H,1-2H2
InChI Key:
GGDYAKVUZMZKRV-UHFFFAOYSA-N
SMILES:
OCCF
EC Number:
206-740-2
UNII:
4M427A5HML
NSC Number:
158283
Properties
Complexity:
10  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
64.032g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
64.059g/mol
Monoisotopic Mass:
64.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Literature
Title Journal
Novel coumarins and 2-thioxo-coumarins as inhibitors of the tumor-associated carbonic anhydrases IX and XII. Bioorganic & medicinal chemistry 20120401
Isoflavones-Enriched Soy Protein Prevents CCL(4)-Induced Hepatotoxicity in Rats. ISRN pharmacology 20120101
Preclinical evaluation of an 18F-labelled beta1-adrenoceptor selective radioligand based on ICI 89,406. Nuclear medicine and biology 20100501
Influence of fluorine atoms and aromatic rings on the acidity of ethanol. The journal of physical chemistry. A 20091008
Molecular self-recognition: rotational spectra of the dimeric 2-fluoroethanol conformers. Chemistry (Weinheim an der Bergstrasse, Germany) 20090101
Phenolic derivatives from soy flour ethanol extract are potent in vitro quinone reductase (QR) inducing agents. Journal of agricultural and food chemistry 20081126
Synthesis and biological evaluation of substituted [18F]imidazo[1,2-a]pyridines and [18F]pyrazolo[1,5-a]pyrimidines for the study of the peripheral benzodiazepine receptor using positron emission tomography. Journal of medicinal chemistry 20080710
Tailoring the key in a molecular lock-and-key model system: the propylene oxide...2-fluoroethanol complex. Journal of the American Chemical Society 20080507
Metabolism of mono- and dihalogenated C1 and C2 compounds by Xanthobacter autotrophicus growing on 1,2-dichloroethane. Biodegradation 20070401
Energetics of C-F, C-Cl, C-Br, and C-I bonds in 2-haloethanols. enthalpies of formation of XCH(2)CH(2)OH (X = F, Cl, Br, I) compounds and of the 2-hydroxyethyl radical. The journal of physical chemistry. A 20070308
The observation of a large gauche preference when 2-fluoroethylamine and 2-fluoroethanol become protonated. Organic & biomolecular chemistry 20040307
Kinetics and mechanism of the proton transfer to CpFe(dppe)H: absence of a direct protonation at the metal site. Journal of the American Chemical Society 20030910
An automatic method to generate force-field parameters for hetero-compounds. Acta crystallographica. Section D, Biological crystallography 20030201
Ethenesulfonamide and ethanesulfonamide derivatives, a novel class of orally active endothelin-A receptor antagonists. Bioorganic & medicinal chemistry 20011101
Ethenesulfonamide derivatives, a novel class of orally active endothelin-A receptor antagonists. Chemical & pharmaceutical bulletin 20010501
Properties