4-[2-(Dimethylamino)ethoxy]benzenemethanamine

C₁₁H₁₈N₂OCAS 20059-73-8194.28 g/mol

Open in Covalent MOL file

Ether Primary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₈N₂O
Molar mass: 194.28 g/mol
Exact mass: 194.1419 Da
Boiling point: 120–123 °C (at 0.3 Torr)
logP: 1.09Crippen estimate
Polar surface area: 38.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 5

Hazards

Danger

H302 Harmful if swallowed98.3% of notifiers
H314 Causes severe skin burns and eye damage92.5% of notifiers
H318 Causes serious eye damage89.2% of notifiers
H412 Harmful to aquatic life with long lasting effects90% of notifiers

Aggregated from 120 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, P501

Identifiers

CAS number

20059-73-8

SMILES

CN(C)CCOc1ccc(CN)cc1

InChIKey

OBHPRQNPNGQGCK-UHFFFAOYSA-N

InChI

InChI=1S/C11H18N2O/c1-13(2)7-8-14-11-5-3-10(9-12)4-6-11/h3-6H,7-9,12H2,1-2H3

Weigh it out

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

Names and synonyms

9 names

Benzenemethanamine, 4-[2-(dimethylamino)ethoxy]-
Benzylamine, p-[2-(dimethylamino)ethoxy]-
NSC 37857
4-[2-(Dimethylamino)ethoxy]benzylamine
2-[4-(Aminomethyl)phenoxy]-N,N-dimethylethanamine
[2-(4-Aminomethyl-phenoxy)-ethyl]-dimethyl-amine
[4-[2-(Dimethylamino)ethoxy]phenyl]methanamine
[2-[(4-Aminomethylphenyl)oxy]ethyl]dimethylamine
p-(2-(Dimethylamino)ethoxy)benzylamine

Work with 4-[2-(Dimethylamino)ethoxy]benzenemethanamine

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

(4-Isobutoxyphenyl)methanamine4734-09-250 % similar 4-Methoxybenzylamine2393-23-948 % similar Tamoxifen10540-29-144 % similar 4-Dimethylaminobenzylamine19293-58-444 % similar 4-Morpholinobenzylamine214759-74-743 % similar 4-Phenoxybenzenemethanamine107622-80-043 % similar P-Xylylenediamine539-48-043 % similar [4-(4-Methylpiperazin-1-yl)phenyl]methanamine216144-45-542 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-8

Elsewhere

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