2,6-Dimethoxyaniline

C₈H₁₁NO₂CAS 2734-70-5153.18 g/mol

Open in Covalent MOL file

Ether Primary amine

Properties

Molecular formula: C₈H₁₁NO₂
Molar mass: 153.18 g/mol
Exact mass: 153.0790 Da
logP: 1.29Crippen estimate
Polar surface area: 44.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H311 Toxic in contact with skin87.5% of notifiers
H315 Causes skin irritation37.5% of notifiers
H319 Causes serious eye irritation37.5% of notifiers
H332 Harmful if inhaled87.5% of notifiers
H335 May cause respiratory irritation25% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure87.5% of notifiers

Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2734-70-5

SMILES

COC1=C(C(=CC=C1)OC)N

InChIKey

HQBJSEKQNRSDAZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H11NO2/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5H,9H2,1-2H3

Weigh it out

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

Names and synonyms

1 names

Benzenamine, 2,6-dimethoxy-

Work with 2,6-Dimethoxyaniline

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-Methoxy-6-methylaniline50868-73-072 % similar 2-Fluoro-6-methoxyaniline446-61-769 % similar O-Anisidine90-04-058 % similar Methyl 2-amino-3-methoxybenzoate5121-34-658 % similar 3-Methoxy-2-methylaniline19500-02-858 % similar 2,3-Dimethoxyaniline6299-67-858 % similar 1,2-Dimethoxybenzene91-16-757 % similar 1,2,3-Trimethoxybenzene634-36-657 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,5-Dimethoxyaniline102-56-7 3,5-Dimethoxyaniline10272-07-8 Octopamine104-14-3 Hexahydro-1H-isoindole-1,3(2H)-dione1444-94-6 (alphaR)-alpha-Amino-1,4-cyclohexadiene-1-acetic acid26774-88-9 2,4-Dimethoxyaniline2735-04-8 1-Cyanocyclobutanecarboxylic acid ethyl ester28246-87-9 Otava-bb bb71185609093284-47-7

Elsewhere

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