N-(4-Methoxybenzylidene)aniline

C₁₄H₁₃NOCAS 836-41-9211.26 g/mol

Open in Covalent MOL file

Ether Imine

Properties

Molecular formula: C₁₄H₁₃NO
Molar mass: 211.26 g/mol
Exact mass: 211.0997 Da
Melting point: 63 °C
logP: 3.45Crippen estimate
Polar surface area: 21.6 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 39 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

836-41-9

SMILES

COc1ccc(C=Nc2ccccc2)cc1

InChIKey

MSWPGMRTURVKRJ-UHFFFAOYSA-N

InChI

InChI=1S/C14H13NO/c1-16-14-9-7-12(8-10-14)11-15-13-5-3-2-4-6-13/h2-11H,1H3

Weigh it out

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

Names and synonyms

13 names · show all

NSC 155535
Benzenamine, N-[(4-methoxyphenyl)methylene]-
Aniline, N-(p-methoxybenzylidene)-
N-[(4-Methoxyphenyl)methylene]benzenamine
(p-Methoxybenzylidene)aniline
N-(p-Methoxybenzylidene)aniline
p-Methoxybenzaldehyde anil
p-Methoxybenzalaniline
(4-Methoxybenzylidene)aniline
(4-Methoxyphenylmethylene)(phenyl)amine
(4-Methoxybenzylidene)phenylamine
N-[(4-Methoxyphenyl)methylene]phenylamine
N-Phenyl-4-methoxybenzylideneimine

Work with N-(4-Methoxybenzylidene)aniline

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

Mbba26227-73-663 % similar N-Benzylideneaniline538-51-261 % similar 4-Methoxybenzaldehyde azine2299-73-260 % similar 4-Methoxystilbene1142-15-058 % similar 4-Methoxyazobenzene2396-60-358 % similar Anisole100-66-350 % similar Photoanethole15638-14-950 % similar 4-Vinylanisole637-69-450 % similar

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

Same formula

Carbazole-9-ethanol1484-14-6 N-Benzylbenzamide1485-70-7 N,N-Diphenylacetamide519-87-9 Benzyl phenyl ketoxime952-06-7

Elsewhere

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