N-Methyl-N-octyl-1-octanamine

C₁₇H₃₇NCAS 4455-26-9255.49 g/mol

Open in Covalent MOL file

Tertiary amine

Properties

Molecular formula: C₁₇H₃₇N
Molar mass: 255.49 g/mol
Exact mass: 255.2926 Da
Density: 0.8006 g/mL (at 20 °C)
Melting point: −30.1 °C
Boiling point: 136–138 °C
logP: 5.64Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 14

Hazards

Warning

H315 Causes skin irritation93.5% of notifiers
H319 Causes serious eye irritation93.5% of notifiers
H335 May cause respiratory irritation82.6% of notifiers
H400 Very toxic to aquatic life95.7% of notifiers
H410 Very toxic to aquatic life with long lasting effects10.9% of notifiers

Aggregated from 46 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

4455-26-9

SMILES

CCCCCCCCN(C)CCCCCCCC

InChIKey

YJLYANLCNIKXMG-UHFFFAOYSA-N

InChI

InChI=1S/C17H37N/c1-4-6-8-10-12-14-16-18(3)17-15-13-11-9-7-5-2/h4-17H2,1-3H3

Weigh it out

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

Names and synonyms

9 names

1-Octanamine, N-methyl-N-octyl-
Dioctylamine, N-methyl-
Methyldioctylamine
N-Methyldioctylamine
Dioctylmethylamine
Di-n-octylmethylamine
N,N-Dioctyl-N-methylamine
N-Methyl-N-octyloctan-1-amine
N,N-Dioctylmethylamine

Work with N-Methyl-N-octyl-1-octanamine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methyl-N-octyl-1-decanamine22020-14-0100 % similar Dioctadecylmethylamine4088-22-6100 % similar Didecylmethylamine7396-58-9100 % similar N-Methylpiperidine626-67-571 % similar 1-Methylpyrrolidine120-94-565 % similar Lauryldimethylamine112-18-562 % similar Dimethylhexadecylamine112-69-662 % similar Tetradecyldimethylamine112-75-462 % similar

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

Same formula

Heptadecylamine4200-95-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook