4,4′-Ethylenedianiline

C₁₄H₁₆N₂CAS 621-95-4212.30 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₁₄H₁₆N₂
Molar mass: 212.30 g/mol
Exact mass: 212.1313 Da
Melting point: 137 °C
logP: 2.64Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation61.3% of notifiers
H319 Causes serious eye irritation61.3% of notifiers
H335 May cause respiratory irritation50% of notifiers
H400 Very toxic to aquatic life38.8% of notifiers
H410 Very toxic to aquatic life with long lasting effects38.8% of notifiers

Aggregated from 80 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

621-95-4

SMILES

Nc1ccc(CCc2ccc(N)cc2)cc1

InChIKey

UHNUHZHQLCGZDA-UHFFFAOYSA-N

InChI

InChI=1S/C14H16N2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,1-2,15-16H2

Weigh it out

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

Names and synonyms

18 names · show all

4,4'-Ethylenedianiline
Benzenamine, 4,4′-(1,2-ethanediyl)bis-
α,α′-Bi-p-toluidine
4,4′-(1,2-Ethanediyl)bis[benzenamine]
4,4′-Diaminobibenzyl
1,2-Bis(p-aminophenyl)ethane
1,2-Bis(4-aminophenyl)ethane
4,4′-Diaminodibenzyl
4,4′-Dibenzyldiamine
4,4′-Diaminodiphenylethane
p,p′-Diaminobibenzyl
p,p′-Diaminodibenzyl
4,4′-Ethylenebisaniline
NSC 44062
NSC 580
NSC 60033
1,2-Di(4-aminophenyl)ethane
4,4′-Diamino-1,2-diphenylethane

Work with 4,4′-Ethylenedianiline

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

4,4′-Methylenedianiline101-77-971 % similar 2-(4-Aminophenyl)ethylamine13472-00-968 % similar 2-(4-Aminophenyl)ethanol104-10-965 % similar 4-Propylaniline2696-84-665 % similar P-Phenylenediamine106-50-364 % similar 4-Aminobenzylamine4403-71-863 % similar 4-Ethylaniline589-16-260 % similar 4-Aminobenzyl alcohol623-04-160 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Atipamezole104054-27-5 Tolidine119-93-7 N,N'-Diphenylethylenediamine150-61-8 Rel-(1R,2R)-1,2-Diphenyl-1,2-ethanediamine16635-95-3 (1S,2S)-1,2-Diphenylethane-1,2-diamine29841-69-8 Diphenylethylenediamine35132-20-8 1-(1-Naphthyl)piperazine57536-86-4 2,2′-Dimethylbenzidine84-67-3

Elsewhere

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