Bis(2-ethylhexyl)amine

C₁₆H₃₅NCAS 106-20-7241.46 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₆H₃₅N
Molar mass: 241.46 g/mol
Exact mass: 241.2770 Da
Density: 0.8062 g/mL (at 20 °C)
Boiling point: 126 °C (at 4 Torr)
Flash point: 132.2 °C
Water solubility: < 1 g/L (21.1 °C)
logP: 5.01Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 12

Hazards

Danger

H302+H312 Harmful if swallowed or in contact with skin65.9% of notifiers
H302 Harmful if swallowed99.7% of notifiers
H311 Toxic in contact with skin29.3% of notifiers
H312 Harmful in contact with skin70.6% of notifiers
H314 Causes severe skin burns and eye damage99.9% of notifiers
H318 Causes serious eye damage88.9% of notifiers
H330 Fatal if inhaled66.1% of notifiers
H331 Toxic if inhaled27.1% of notifiers
H410 Very toxic to aquatic life with long lasting effects23.6% of notifiers
H411 Toxic to aquatic life with long lasting effects70.1% of notifiers

Aggregated from 669 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P362+P364, P363, P391, P403+P233, P405, P501

Identifiers

CAS number

106-20-7

SMILES

CCCCC(CC)CNCC(CC)CCCC

InChIKey

SAIKULLUBZKPDA-UHFFFAOYSA-N

InChI

InChI=1S/C16H35N/c1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2/h15-17H,5-14H2,1-4H3

Weigh it out

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

Names and synonyms

8 names

1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-
Dihexylamine, 2,2′-diethyl-
2-Ethyl-N-(2-ethylhexyl)-1-hexanamine
Di(2-ethylhexyl)amine
2,2′-Diethyldihexylamine
NSC 5329
N,N-Bis(2-ethylhexyl)amine
N,N-Di(2-ethylhexyl)amine

Work with Bis(2-ethylhexyl)amine

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

Di(2-ethylhexyl)ether10143-60-960 % similar 2-Ethylhexylamine104-75-656 % similar 2-Ethylhexanol104-76-756 % similar 3-(Chloromethyl)heptane123-04-656 % similar Tris(2-ethylhexyl)amine1860-26-056 % similar 2-Ethylhexyl bromide18908-66-256 % similar 2-Ethyl-1-hexanethiol7341-17-556 % similar 1-Bromo-3-ethylheptane227953-67-554 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Dioctylamine1120-48-5 Tetradecyldimethylamine112-75-4 Hexadecylamine143-27-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook