2,3-Dimethoxyaniline

C₈H₁₁NO₂CAS 6299-67-8153.18 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

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 irritation50% of notifiers

Aggregated from 4 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

6299-67-8

SMILES

COC1=CC=CC(=C1OC)N

InChIKey

HEZIOZBMPKPOER-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Work with 2,3-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

1,2,3-Trimethoxybenzene634-36-670 % similar O-Anisidine90-04-064 % similar 3-Methoxy-2-methylaniline19500-02-863 % similar 2-Chloro-3-methoxyaniline113206-03-461 % similar 2-Amino-6-bromoanisole116557-46-161 % similar 3-Fluoro-2-methoxyaniline437-83-259 % similar 2-Anisidine hydrochloride134-29-257 % similar 2,3-Dimethoxytoluene4463-33-657 % 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 2,6-Dimethoxyaniline2734-70-5 2,4-Dimethoxyaniline2735-04-8 1-Cyanocyclobutanecarboxylic acid ethyl ester28246-87-9

Elsewhere

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