4-Bromo-2,6-dimethylbenzenamine

C₈H₁₀BrNCAS 24596-19-8200.08 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₈H₁₀BrN
Molar mass: 200.08 g/mol
Exact mass: 198.9997 Da
Melting point: 47 °C
Boiling point: 120 °C (at 0.22 Torr)
logP: 2.65Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed18.4% of notifiers
H312 Harmful in contact with skin16.3% of notifiers
H315 Causes skin irritation95.9% of notifiers
H319 Causes serious eye irritation14.3% of notifiers
H332 Harmful if inhaled16.3% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled79.6% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure10.2% of notifiers

Aggregated from 49 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P501

Identifiers

CAS number

24596-19-8

SMILES

Cc1cc(Br)cc(C)c1N

InChIKey

QGLAYJCJLHNIGJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H10BrN/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.

Names and synonyms

7 names

2,6-Dimethyl-4-bromoaniline
Benzenamine, 4-bromo-2,6-dimethyl-
2,6-Xylidine, 4-bromo-
4-Bromo-2,6-dimethylaniline
4-Bromo-2,6-xylidine
NSC 227944
4-Bromo-2,6-dimethylphenylamine

Work with 4-Bromo-2,6-dimethylbenzenamine

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

5-Bromo-3-methyl-benzene-1,2-diamine76153-06-575 % similar 4-Bromo-2-chloro-6-methylbenzenamine30273-42-869 % similar 3,3′,5,5′-Tetramethylbenzidine54827-17-759 % similar 2,4,6-Trimethylaniline88-05-157 % similar 2-Amino-5-bromo-3-methylbenzoic acid206548-13-256 % similar 4-Bromo-2-methyl-6-nitrobenzenamine77811-44-056 % similar 5-Bromo-2-iodo-1,3-dimethylbenzene206559-43-554 % similar 4-Amino-3,5-dimethylphenol3096-70-654 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(S)-1-(3-Bromophenyl)ethylamine139305-96-7 3-Bromo-N,N-dimethylaniline16518-62-0 (R)-1-(3-Bromophenyl)ethanamine176707-77-0 1-(4-Bromophenyl)ethylamine24358-62-1 (αS)-4-Bromo-α-methylbenzenemethanamine27298-97-1 4-Bromo-2-methylbenzylamine376646-62-7 2-Bromo-4,6-dimethylbenzenamine41825-73-4 4-Bromo-2-ethylaniline45762-41-2

Elsewhere

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