N,N-Diisopropylethylenediamine

C₈H₂₀N₂CAS 121-05-1144.26 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₈H₂₀N₂
Molar mass: 144.26 g/mol
Exact mass: 144.1626 Da
Melting point: 109–111.5 °C
Boiling point: 38 °C (at NaN Torr)
logP: 1.06Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4

Hazards

Danger

H226 Flammable liquid and vapor99.4% of notifiers
H302 Harmful if swallowed69.4% of notifiers
H314 Causes severe skin burns and eye damage73.9% of notifiers
H315 Causes skin irritation26.1% of notifiers
H318 Causes serious eye damage69.4% of notifiers
H335 May cause respiratory irritation26.8% of notifiers

Aggregated from 157 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

121-05-1

SMILES

CC(C)N(CCN)C(C)C

InChIKey

CURJNMSGPBXOGK-UHFFFAOYSA-N

InChI

InChI=1S/C8H20N2/c1-7(2)10(6-5-9)8(3)4/h7-8H,5-6,9H2,1-4H3

Weigh it out

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

Names and synonyms

13 names · show all

1,2-Ethanediamine, N1,N1-bis(1-methylethyl)-
Ethylenediamine, N,N-diisopropyl-
1,2-Ethanediamine, N,N-bis(1-methylethyl)-
N1,N1-Bis(1-methylethyl)-1,2-ethanediamine
2-(Diisopropylamino)ethylamine
N,N-Diisopropyl-1,2-ethanediamine
2-(Diisopropylamino)ethanamine
N-(N,N-Diisopropylamino)ethylamine
N,N-Bis(1-methylethyl)-1,2-ethanediamine
NSC 166335
[2-(Diisopropylamino)ethan-1-yl]amine
(2-Aminoethyl)bis(propan-2-yl)amine
2-Aminoethyldiisopropylamine

Work with N,N-Diisopropylethylenediamine

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

N,N-Diisopropylaminoethanol96-80-048 % similar 2-Chloroethyldiisopropylammonium chloride4261-68-142 % similar 1,1-Dimethylethylenediamine108-00-941 % similar N,N-Diisopropylethylamine7087-68-541 % similar 1-(2-Diisopropylaminoethyl)piperazine59955-93-041 % similar Tris(2-aminoethyl)amine4097-89-640 % similar 1,4-Piperazinediethanamine6531-38-038 % similar N,N-Diethylethylenediamine100-36-738 % similar

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

Same formula

N1,N1,N4,N4-Tetramethyl-1,4-butanediamine111-51-3 N1,N6-Dimethyl-1,6-hexanediamine13093-04-4 N,N-Diethyl-1,4-butanediamine27431-62-5 Octamethylenediamine373-44-4 N,N′-Diisopropylethylenediamine4013-94-9 N1,N1,N3,N3-Tetramethyl-1,3-butanediamine97-84-7

Elsewhere

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