N1,N1-Dibutyl-1,2-ethanediamine

C₁₀H₂₄N₂CAS 3529-09-7172.32 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₁₀H₂₄N₂
Molar mass: 172.32 g/mol
Exact mass: 172.1939 Da
Density: 0.8255 g/mL (at 20 °C)
Melting point: 187–188 °C
Boiling point: 98–101 °C (at 13 Torr)
logP: 1.85Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 8

Hazards

Danger

H314 Causes severe skin burns and eye damage97.7% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

3529-09-7

SMILES

CCCCN(CCN)CCCC

InChIKey

PWNDYKKNXVKQJO-UHFFFAOYSA-N

InChI

InChI=1S/C10H24N2/c1-3-5-8-12(10-7-11)9-6-4-2/h3-11H2,1-2H3

Weigh it out

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

Names and synonyms

10 names

1,2-Ethanediamine, N1,N1-dibutyl-
Ethylenediamine, N,N-dibutyl-
1,2-Ethanediamine, N,N-dibutyl-
N,N-Dibutylethylenediamine
2-(Dibutylamino)ethylamine
N,N-Dibutyl-1,2-ethanediamine
NSC 100948
N,N-Dibutyl-1,2-diaminoethane
(2-Aminoethyl)dibutylamine
1,2-Ethanediamine N1,N1-dibutyl-

Reactions

β-DI-n-BUTYLAMINOETHYLAMINE (Ethylenediamine, N,N-dibutyl-)product

Work with N1,N1-Dibutyl-1,2-ethanediamine

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

N1,N1-Dibutyl-1,3-propanediamine102-83-081 % similar Tributylamine102-82-968 % similar N,N-Bis(3-aminopropyl)dodecylamine2372-82-967 % similar 1-Pyrrolidineethanamine7154-73-665 % similar 1-Butylpyrrolidine767-10-265 % similar 1-Piperidineethanamine27578-60-562 % similar Tris(2-aminoethyl)amine4097-89-658 % similar Tripentylamine621-77-257 % similar

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

Same formula

Tetramethylhexamethylenediamine111-18-2 N,N,N′,N′-Tetraethylethylenediamine150-77-6 N,N′-Di-tert-butylethylenediamine4062-60-6 1,10-Decanediamine646-25-3

Elsewhere

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