2-(4-Aminophenyl)ethylamine

C₈H₁₂N₂CAS 13472-00-9136.20 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₈H₁₂N₂
Molar mass: 136.20 g/mol
Exact mass: 136.1000 Da
Melting point: 62–63 °C
Boiling point: 140–142 °C (at 12 Torr)
logP: 0.77Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed16.7% of notifiers
H312 Harmful in contact with skin16.7% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H332 Harmful if inhaled16.7% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, P501

Identifiers

CAS number

13472-00-9

SMILES

NCCc1ccc(N)cc1

InChIKey

LNPMZQXEPNWCMG-UHFFFAOYSA-N

InChI

InChI=1S/C8H12N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6,9-10H2

Weigh it out

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

Names and synonyms

19 names · show all

Benzeneethanamine, 4-amino-
Phenethylamine, p-amino-
4-Aminobenzeneethanamine
4-Aminophenylethylamine
4-Amino-β-phenylethylamine
p-(2-Aminoethyl)aniline
4-Amino-β-phenethylamine
β-(4-Aminophenyl)ethylamine
4-(2-Aminoethyl)aniline
β-(p-Aminophenyl)ethylamine
p-Aminophenethylamine
4-Aminophenethylamine
2-(p-Aminophenyl)ethylamine
2-(4-Aminophenyl)phenethylamine
(p-Aminophenyl)ethylamine
4-(2-Aminoethyl)phenylamine
NSC 299558
NSC 9060
4-(2-Aminoethyl)benzenamine

Work with 2-(4-Aminophenyl)ethylamine

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′-Ethylenedianiline621-95-468 % similar 4-Aminobenzylamine4403-71-859 % similar 4,4'-Methylenedianiline101-77-957 % similar 2-(4-Aminophenyl)ethanol104-10-954 % similar 2-(4-Chlorophenyl)ethylamine156-41-254 % similar 4-Propylaniline2696-84-654 % similar 4-Methylphenethylamine3261-62-954 % similar Tyramine51-67-254 % similar

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

Same formula

Tetramethylpyrazine1124-11-4 2,5-Diethylpyrazine13238-84-1 2-Ethyl-3,5-dimethylpyrazine13925-07-0 M-Xylylenediamine1477-55-0 2,3-Diethylpyrazine15707-24-1 2,3-Dimethyl-5-ethylpyrazine15707-34-3 2-Methyl-3-propylpyrazine15986-80-8 N-Phenylethylenediamine1664-40-0

Elsewhere

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