O-Anisidine

C₇H₉NOCAS 90-04-0123.15 g/mol

Open in Covalent MOL file

Ether Primary amine

Properties

Molecular formula: C₇H₉NO
Molar mass: 123.15 g/mol
Exact mass: 123.0684 Da
Density: 1.098 g/mL (at 15 °C)
Melting point: 5 °C
Boiling point: 225 °C
pKa: 4.53 (conjugate acid)
Flash point: 107 °C (closed cup)
Water solubility: 15 g/L (20 °C)
logP: 1.28Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowedAcute toxicity, oral
H311 Toxic in contact with skinAcute toxicity, dermal
H331 Toxic if inhaledAcute toxicity, inhalation
H341 Suspected of causing genetic defectsGerm cell mutagenicity
H350 May cause cancerCarcinogenicity

Harmonised EU classification (CLP Annex VI, index 612-035-00-4), via PubChem.

Precautionary statements

P203, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P318, P321, P330, P361+P364, P403+P233, P405, P501

Identifiers

CAS number

90-04-0

SMILES

COc1ccccc1N

InChIKey

VMPITZXILSNTON-UHFFFAOYSA-N

InChI

InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3

Weigh it out

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

Names and synonyms

13 names · show all

Benzenamine, 2-methoxy-
2-Methoxybenzenamine
o-Aminoanisole
2-Aminoanisole
2-Methoxyaniline
o-Methoxyaniline
o-Methoxyphenylamine
1-Amino-2-methoxybenzene
2-Methoxy-1-aminobenzene
o-Aminomethoxybenzene
2-Methoxyphenylamine
2-Aminomethoxybenzene
NSC 3122

Work with O-Anisidine

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-Anisidine hydrochloride134-29-2Salt

Similar compounds

1,2-Dimethoxybenzene91-16-765 % similar 3-Methoxy-2-methylaniline19500-02-864 % similar 2,3-Dimethoxyaniline6299-67-864 % similar 2-Chloro-3-methoxyaniline113206-03-462 % similar 2,6-Dimethoxyaniline2734-70-558 % similar 2,2'-Dimethoxybiphenyl4877-93-457 % similar 2,2′-[1,2-Ethanediylbis(oxy)]bis[benzenamine]52411-34-456 % similar para-Cresidine120-71-856 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Methoxy-4-methylpyridine100848-70-2 (5-Methylpyridin-3-yl)methanol102074-19-1 2-Pyridineethanol103-74-2 P-Anisidine104-94-9 2,6-Dimethylpyridine N-oxide1073-23-0 2,6-Dimethyl-3-pyridinol1122-43-6 6-Methyl-2-pyridinemethanol1122-71-0 2-Methoxy-5-picoline13472-56-5

Elsewhere

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