1-Ethoxy-3-fluorobenzene

C8H9FOCAS 458-03-7140.16 g/mol

Open in Covalent MOL file
OF
Aryl halideEther

Properties

Molecular formula
C8H9FO
Molar mass
140.16 g/mol
Exact mass
140.0637 Da
Density
1.0716 g/mL (at 18.4 °C)
Melting point
−27.5 °C
Boiling point
172 °C
logP
2.22Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
458-03-7
SMILES
CCOc1cccc(F)c1
InChIKey
UWWCZZMOTBWUAB-UHFFFAOYSA-N
InChI
InChI=1S/C8H9FO/c1-2-10-8-5-3-4-7(9)6-8/h3-6H,2H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

4 names
  • Benzene, 1-ethoxy-3-fluoro-
  • Phenetole, m-fluoro-
  • 3-Fluorophenetole
  • m-Fluorophenyl ethyl ether

Work with 1-Ethoxy-3-fluorobenzene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Diethoxybenzene2049-73-272 % similar 1-Ethoxy-4-fluorobenzene459-26-761 % similar 3-Ethoxy thiophenol86704-82-760 % similar 1-Bromo-3-ethoxybenzene2655-84-758 % similar 3-Ethoxybenzenamine621-33-058 % similar 3-Ethoxyphenol621-34-158 % similar Ethyl phenyl ether103-73-156 % similar 1-Fluoro-3-methoxybenzene456-49-555 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(R)-1-(4-Fluorophenyl)ethanol101219-68-5 (-)-1-(4-Fluorophenyl)ethanol101219-73-2 (S)-1-(2-Fluorophenyl)ethanol171032-87-4 3-Fluoro-4-methylbenzyl alcohol192702-79-7 1-Fluoro-4-methoxy-2-methylbenzene2338-54-7 4-Fluoro-1-methoxy-2-methylbenzene399-54-2 2-Fluoro-4-methylanisole399-55-3 3-Fluoro-alpha-methylbenzenemethanol402-63-1

Elsewhere

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