chempirical

1-Chloro-2-ethoxybenzene

C8H9ClOCAS 614-72-2156.61 g/mol

Open in Covalent MOL file
OCl
Aryl halideEther

Properties

Molecular formula
C8H9ClO
Molar mass
156.61 g/mol
Exact mass
156.0342 Da
Melting point
190–191.5 °C
Boiling point
210 °C
logP
2.74Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
614-72-2
SMILES
CCOc1ccccc1Cl
InChIKey
IRYSAAMKXPLGAM-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzene, 1-chloro-2-ethoxy-
  • Phenetole, o-chloro-
  • 2-Chlorophenol ethyl ether
  • o-Chlorophenyl ethyl ether
  • o-Chlorophenetole
  • NSC 6160
  • 2-Chlorophenetole

Work with 1-Chloro-2-ethoxybenzene

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

1,2-Diethoxybenzene2050-46-667 % similar 2-Chloro-1,4-diethoxybenzene52196-74-463 % similar 2-(2-Chlorophenoxy)ethanol15480-00-960 % similar 1-Ethoxynaphthalene5328-01-857 % similar 3-Chloro-4-ethoxyphenylboronic acid279261-81-354 % similar 2-Chloroanisole766-51-854 % similar 1-(2-Bromoethoxy)-2-ethoxybenzene3259-03-853 % similar 1-Ethoxy-2-fluorobenzene451-80-953 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Chloro-2,6-dimethylphenol1123-63-3 (1R)-1-(3-Chlorophenyl)ethanol120121-01-9 (1R)-1-(2-Chlorophenyl)ethan-1-ol120466-66-2 (S)-1-(2-Chlorophenyl)ethanol131864-71-6 1-Chloro-4-methoxy-2-methylbenzene13334-71-9 (1S)-1-(3-Chlorophenyl)ethan-1-ol135145-34-5 1-(2-Chlorophenyl)ethanol13524-04-4 4-Chloro-3-ethylphenol14143-32-9

Elsewhere

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