2,4-Diaminoanisole

C₇H₁₀N₂OCAS 615-05-4138.17 g/mol

Open in Covalent MOL file

Ether Primary amine

Properties

Molecular formula: C₇H₁₀N₂O
Molar mass: 138.17 g/mol
Exact mass: 138.0793 Da
Melting point: 67–68 °C
Boiling point: 221 °C
Water solubility: miscible
logP: 0.86Crippen estimate
Polar surface area: 61.3 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H341 Suspected of causing genetic defectsGerm cell mutagenicity
H350 May cause cancerCarcinogenicity
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 612-200-00-0[1]), via PubChem.

Precautionary statements

P203, P264, P270, P273, P280, P301+P317, P318, P330, P391, P405, P501

Identifiers

CAS number

615-05-4

SMILES

COc1ccc(N)cc1N

InChIKey

BAHPQISAXRFLCL-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N2O/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,8-9H2,1H3

Weigh it out

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

Names and synonyms

17 names · show all

1,3-Benzenediamine, 4-methoxy-
m-Phenylenediamine, 4-methoxy-
4-Methoxy-1,3-benzenediamine
C.I. 76050
C.I. Oxidation base 12
Furro L
Pelagol L
Pelagol DA
Pelagol grey L
4-Methoxy-m-phenylenediamine
1,3-Diamino-4-methoxybenzene
p-Methoxy-m-phenylenediamine
3-Amino-4-methoxyaniline
2,4-Diaminophenyl methyl ether
4-Methoxy-1,3-phenylenediamine
2,4-Diamino-1-methoxybenzene
1-Methoxy-2,4-diaminobenzene

Work with 2,4-Diaminoanisole

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2,4-Diaminoanisole sulfate39156-41-7Salt 2,4-Diaminoanisole dihydrochloride614-94-8Salt 1,3-Benzenediamine, 4-methoxy-, sulfate, hydrate (1:1:?)123333-56-2Salt

Similar compounds

3,4-Dimethoxyaniline6315-89-572 % similar 2,5-Dimethoxyaniline102-56-763 % similar 5-Amino-2-methoxyphenol1687-53-262 % similar 3-Bromo-4-methoxyaniline19056-41-862 % similar 3-Fluoro-4-methoxyaniline366-99-462 % similar 3-Chloro-4-methoxyaniline5345-54-062 % similar 3-Iodo-4-methoxybenzenamine74587-12-562 % similar para-Cresidine120-71-861 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Methoxy-1,2-phenylenediamine102-51-2 β-Oxo-1-pyrrolidinepropanenitrile14227-95-3 4-Ethoxy-3-pyridinamine1633-43-8 3-Amino-2-methoxy-6-picoline186413-79-6 2-Ethyl-3-methoxypyrazine25680-58-4 1,3,5-Trimethyl-1H-pyrazole-4-carboxaldehyde2644-93-1 2-(Methylamino)-3-pyridinemethanol32399-12-5 2-Ethoxy-3-methylpyrazine32737-14-7

Elsewhere

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