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1-(3-Fluorophenyl)ethanol structure

1-(3-Fluorophenyl)ethanol

  • CAS:402-63-1
  • MW:140.15500
  • MF:C8H9FO
 
1. Names and Identifiers
1.1 Name
1-(3-Fluorophenyl)ethanol
1.2 Synonyms
(±)-1-(m-Fluorophenyl)ethanol; 1-(3'-FLUOROPHENYL)-1-HYDROXYETHANE; 1-(3-FLUOROPHENYL)ETHAN-1-OL; 3-Fluoro-alpha-methylbenzyl alcohol; 3-Fluoro-alpha-methylbenzyl alcohol~3-Fluorophenyl methyl carbinol; 3-FLUOROPHENYL METHYL CARBINOL; 3-Fluoro-α-methylbenzenemethanol; ALPHA-METHYL-3-FLUOROBENZYL ALCOHOL; Benzenemethanol, 3-fluoro-alpha-methyl-; Benzenemethanol, 3-fluoro-α-methyl-; Benzyl alcohol, m-fluoro-α-methyl-; m-Fluorophenylmethylcarbinol; NSC 2996;
1.3 CAS No.
402-63-1
1.4 CID
95348
1.5 EINECS
206-950-4
1.6 Molecular Formula
C8H9FO
1.7 Inchi
InChI=1S/C8H9FO/c1-6(10)7-3-2-4-8(9)5-7/h2-6,10H,1H3
1.8 InChkey
YESOPGLEIJQAEF-UHFFFAOYSA-N
1.9 Canonical Smiles
CC(C1=CC(=CC=C1)F)O
1.10 Isomers Smiles
CC(C1=CC(=CC=C1)F)O
2. Properties
2.1 Storage
Ambient temperatures.
2.2 pKa
14.16±0.20(Predicted)
3. Use and Manufacturing
3.1 Description
1-(3-Fluorophenyl)ethanol (CAS 402-63-1) is a chemical compound that appears as a colorless to pale yellow liquid. It has a basic structure consisting of a phenyl group attached to an ethanol molecule. This compound is soluble in organic solvents such as ethanol and acetone, but has limited solubility in water. It has a molecular weight of 138.16 g/mol and a boiling point of 187-189°C.

Applicable Fields
1-(3-Fluorophenyl)ethanol has various applications in different fields:

Pharmaceutical Industry: This chemical is used as an intermediate in the synthesis of pharmaceutical compounds. It can be utilized in the production of drugs such as antiviral agents, antifungal agents, and analgesics. The mechanism of action of 1-(3-Fluorophenyl)ethanol in pharmaceutical applications may vary depending on the specific drug being synthesized.

Chemical Research: Researchers may use 1-(3-Fluorophenyl)ethanol as a starting material or reagent in various chemical reactions. It can be employed in the synthesis of organic compounds, such as aromatic derivatives or fluorinated compounds. The mechanism of action in chemical research applications depends on the specific reaction being conducted.

Storage Conditions
Store in a cool, dry place.
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

5. NMR Spectrum
Mass spectrum (electron ionization)  
6. Synthesis Route
402-63-1Total: 9 Synthesis Route
 
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7. Precursor and Product
precursor:
product:
8. Computed Properties
9. Toltal 30 Suppliers View more
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10. Realated Product Infomation
 
 
 
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