2-Anisidine hydrochloride

C₇H₁₀ClNOCAS 134-29-2159.61 g/mol

Open in Covalent MOL file

Ether Primary amine

Properties

Molecular formula: C₇H₁₀ClNO
Molar mass: 159.61 g/mol
Exact mass: 159.0451 Da
Melting point: 228–230 °C
Water solubility: 10–50 g/L (21.1 °C)
logP: 1.70Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H301+H311+H331 Toxic if swallowed, in contact with skin or if inhaled50% of notifiers
H301 Toxic if swallowed100% of notifiers
H311 Toxic in contact with skin100% of notifiers
H319 Causes serious eye irritation50% of notifiers
H331 Toxic if inhaled100% of notifiers
H341 Suspected of causing genetic defects100% of notifiers
H350 May cause cancer50% of notifiers
H351 Suspected of causing cancer50% of notifiers
H371 May cause damage to organs50% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P308+P316, P316, P318, P319, P321, P330, P337+P317, P361+P364, P403+P233, P405, P501

Identifiers

CAS number

134-29-2

SMILES

COc1ccccc1N.Cl

InChIKey

XCZCWGVXRBJCCD-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

8 names

O-Anisidine, hydrochloride
Benzenamine, 2-methoxy-, hydrochloride (1:1)
Benzenamine, 2-methoxy-, hydrochloride
C.I. 37115
Fast red BB base
2-Methoxyaniline hydrochloride
o-Methoxyaniline hydrochloride
2-Methoxybenzenamine hydrochloride

Work with 2-Anisidine hydrochloride

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

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.

O-Anisidine90-04-0Free base

Similar compounds

2-Chloro-3-methoxyaniline hydrochloride85893-87-466 % similar 3,3′-Dimethoxybenzidine dihydrochloride20325-40-059 % similar 3-Methoxy-2-methylaniline19500-02-857 % similar 2,3-Dimethoxyaniline6299-67-857 % similar 2-Methoxyphenylhydrazine hydrochloride57396-67-557 % similar 2,4-Diaminoanisole dihydrochloride614-94-857 % similar o-Methoxyphenylhydrazine hydrochloride6971-45-557 % similar 1,2-Dimethoxybenzene91-16-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Methoxyaniline hydrochloride20265-97-8 O-Benzylhydroxylamine hydrochloride2687-43-6 N-Benzylhydroxylamine hydrochloride29601-98-7

Elsewhere

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