2-(4-Chlorophenoxy)benzenamine

C₁₂H₁₀ClNOCAS 2770-11-8219.67 g/mol

Open in Covalent MOL file

Aryl halide Ether Primary amine

Properties

Molecular formula: C₁₂H₁₀ClNO
Molar mass: 219.67 g/mol
Exact mass: 219.0451 Da
Boiling point: 202 °C (at 13 Torr)
logP: 3.71Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

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, P403+P233, P405, P501

Identifiers

CAS number

2770-11-8

SMILES

Nc1ccccc1Oc1ccc(Cl)cc1

InChIKey

QKKBREBZMUFUDS-UHFFFAOYSA-N

InChI

InChI=1S/C12H10ClNO/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h1-8H,14H2

Weigh it out

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

Names and synonyms

6 names

Benzenamine, 2-(4-chlorophenoxy)-
Aniline, o-(p-chlorophenoxy)-
2-(p-Chlorophenoxy)aniline
2-(4-Chlorophenoxy)aniline
2-Amino-4′-chlorodiphenyl ether
2-(4-Chlorophenoxy)phenylamine

Work with 2-(4-Chlorophenoxy)benzenamine

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-Phenoxyaniline2688-84-868 % similar 5-Chloro-2-(4-chlorophenoxy)benzenamine121-27-768 % similar 2-(2,4-Dichlorophenoxy)aniline26306-64-960 % similar Chlorophenoxybenzene55398-86-255 % similar 4-Chlorophenyl phenyl ether7005-72-355 % similar 4-Amino-2,4′-dichlorodiphenyl ether24900-79-649 % similar 2-Amino-4'-chlorobiphenyl1204-44-048 % similar 2-(o-Tolyloxy)aniline3840-18-447 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(4-Chlorophenoxy)benzenamine101-79-1 (S)-(4-Chlorophenyl)(pyridin-2-yl)methanol176022-47-2 α-(4-Chlorophenyl)-2-pyridinemethanol27652-89-7 5-Chloro-2-phenoxybenzenamine93-67-4

Elsewhere

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