2-Chloroanisole

C7H7ClOCAS 766-51-8142.58 g/mol

Open in Covalent MOL file
OCl
Aryl halideEther

Properties

Molecular formula
C7H7ClO
Molar mass
142.58 g/mol
Exact mass
142.0185 Da
Density
1.248 g/mL (at 20 °C)
Melting point
−26.8 °C
Boiling point
198.5 °C
logP
2.35Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, P501

Identifiers

CAS number
766-51-8
SMILES
COc1ccccc1Cl
InChIKey
QGRPVMLBTFGQDQ-UHFFFAOYSA-N
InChI
InChI=1S/C7H7ClO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3

Weigh it out

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

Names and synonyms

12 names
  • Benzene, 1-chloro-2-methoxy-
  • Anisole, o-chloro-
  • 1-Chloro-2-methoxybenzene
  • o-Chloroanisole
  • o-Chlorophenyl methyl ether
  • 2-Chlorophenol methyl ether
  • o-Chloromethoxybenzene
  • 2-Chloromethoxybenzene
  • o-Methoxychlorobenzene
  • NSC 155175
  • 2-Methoxyphenyl chloride
  • 2-Methoxy-1-chlorobenzene

Work with 2-Chloroanisole

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

2,3-Dichloroanisole1984-59-468 % similar 1-Chloro-3-methoxy-2-methylbenzene3260-88-665 % similar 3-Chloro-2-fluoroanisole261762-56-563 % similar 1,2-Dimethoxybenzene91-16-762 % similar 1,4-Dichloro-2,5-dimethoxybenzene2675-77-661 % similar 1,4-Dichloro-2-methoxybenzene1984-58-359 % similar 2-Chloro-1,4-dimethoxybenzene2100-42-759 % similar 2,4-Dichloroanisole553-82-259 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-2-methylphenol1570-64-5 2-Chlorobenzyl alcohol17849-38-6 3-Chloroanisole2845-89-8 3-Chloro-2-methylphenol3260-87-5 5-Chloro-2-methylphenol5306-98-9 P-Chlorocresol59-50-7 3-Chloro-4-methylphenol615-62-3 2-Chloro-5-methylphenol615-74-7

Elsewhere

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