4-Chloro-2,6-dimethylaniline

C₈H₁₀ClNCAS 24596-18-7155.63 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₈H₁₀ClN
Molar mass: 155.63 g/mol
Exact mass: 155.0502 Da
logP: 2.54Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed94.1% of notifiers
H315 Causes skin irritation14.7% of notifiers
H318 Causes serious eye damage82.4% of notifiers
H319 Causes serious eye irritation17.6% of notifiers
H335 May cause respiratory irritation14.7% of notifiers
H340 May cause genetic defects82.4% of notifiers
H411 Toxic to aquatic life with long lasting effects82.4% of notifiers

Aggregated from 34 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

24596-18-7

SMILES

CC1=CC(=CC(=C1N)C)Cl

InChIKey

JCLZLZKUISPXDC-UHFFFAOYSA-N

InChI

InChI=1S/C8H10ClN/c1-5-3-7(9)4-6(2)8(5)10/h3-4H,10H2,1-2H3

Weigh it out

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

Work with 4-Chloro-2,6-dimethylaniline

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

2,4-Dichloro-6-methylaniline30273-00-875 % similar 3,3′,5,5′-Tetramethylbenzidine54827-17-759 % similar 2,4,6-Trimethylaniline88-05-157 % similar 2-Amino-5-chloro-3-methylbenzoic acid20776-67-456 % similar 4-Chloro-2-methyl-6-nitroaniline62790-50-556 % similar 4-Amino-3,5-dimethylphenol3096-70-654 % similar 4-Iodo-2,6-dimethylbenzenamine4102-53-854 % similar 4-Chloro-o-toluidine95-69-254 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-N-methylbenzenemethanamine104-11-0 2-(3-Chlorophenyl)ethylamine13078-79-0 2-(2-Chlorophenyl)ethylamine13078-80-3 4-Chloro-N-ethylbenzenamine13519-75-0 2-(4-Chlorophenyl)ethylamine156-41-2 3-Chloro-2,6-dimethylaniline26829-77-6 (+)-1-(4-Chlorophenyl)ethylamine27298-99-3 (-)-1-(4-Chlorophenyl)ethylamine4187-56-8

Elsewhere

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