2,5-Dimethoxyaniline

C₈H₁₁NO₂CAS 102-56-7153.18 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
Melting point: 82.5 °C
Boiling point: 270 °C
logP: 1.29Crippen estimate
Polar surface area: 44.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowed88.5% of notifiers
H302 Harmful if swallowed11.5% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure19.2% of notifiers

Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P301+P316, P301+P317, P319, P321, P330, P405, P501

Identifiers

CAS number

102-56-7

SMILES

COc1ccc(OC)c(N)c1

InChIKey

NAZDVUBIEPVUKE-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

10 names

Benzenamine, 2,5-dimethoxy-
Aniline, 2,5-dimethoxy-
2,5-Dimethoxybenzenamine
C.I. 35811
Aminohydroquinone dimethyl ether
1-Amino-2,5-dimethoxybenzene
NSC 4138
2,5-Dimethoxyphenylamine
2,5-Dimethoxylaniline
2-Methoxy-5-methoxyaniline

Work with 2,5-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Methoxy-1,2-phenylenediamine102-51-268 % similar 1,2,4-Trimethoxybenzene135-77-364 % similar 2,4-Diaminoanisole615-05-463 % similar para-Cresidine120-71-861 % similar 5-Methoxy-o-toluidine50868-72-961 % similar 4-Methoxybenzene-1,2-diamine dihydrochloride59548-39-961 % similar 5-Fluoro-2-methoxyaniline1978-39-859 % similar 2-Amino-4-methoxyphenol20734-76-359 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

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 Otava-bb bb71185609093284-47-7

Elsewhere

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