2,3-Dichloroanisole

C₇H₆Cl₂OCAS 1984-59-4177.02 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₇H₆Cl₂O
Molar mass: 177.02 g/mol
Exact mass: 175.9796 Da
Melting point: 32 °C
logP: 3.00Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H302+H312 Harmful if swallowed or in contact with skin20% of notifiers
H302 Harmful if swallowed60% of notifiers
H315 Causes skin irritation60% of notifiers
H319 Causes serious eye irritation60% of notifiers
H332 Harmful if inhaled20% of notifiers
H335 May cause respiratory irritation60% of notifiers
H412 Harmful to aquatic life with long lasting effects20% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1984-59-4

SMILES

COc1cccc(Cl)c1Cl

InChIKey

HFEASCCDHUVYKU-UHFFFAOYSA-N

InChI

InChI=1S/C7H6Cl2O/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3

Weigh it out

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

Names and synonyms

4 names

Benzene, 1,2-dichloro-3-methoxy-
Anisole, 2,3-dichloro-
1,2-Dichloro-3-methoxybenzene
2,3-Dichlorophenyl methyl ether

Work with 2,3-Dichloroanisole

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,3,4-Trichloroanisole54135-80-769 % similar 2-Chloroanisole766-51-868 % similar 2-Chloro-3-methoxyaniline113206-03-461 % similar 1-Chloro-3-methoxy-2-methylbenzene3260-88-661 % similar 3-Chloro-2-fluoroanisole261762-56-559 % similar 1,4-Dichloro-2,5-dimethoxybenzene2675-77-656 % similar 2-Chloro-3-methoxyaniline hydrochloride85893-87-455 % similar 2-Chloro-6-methoxyphenylboronic acid385370-80-953 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Dichlorobenzyl alcohol15258-73-8 2,4-Dichloro-6-methylphenol1570-65-6 2,4-Dichlorobenzyl alcohol1777-82-8 3,4-Dichlorobenzenemethanol1805-32-9 1,4-Dichloro-2-methoxybenzene1984-58-3 2,6-Dichloroanisole1984-65-2 Alpha,4-Dichloroanisole21151-56-4 2,6-Dichloro-4-methylphenol2432-12-4

Elsewhere

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