Triheptylamine

C₂₁H₄₅NCAS 2411-36-1311.60 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₁H₄₅N
Molar mass: 311.60 g/mol
Exact mass: 311.3552 Da
Boiling point: 330 °C
logP: 7.20Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 18

Identifiers

CAS number

2411-36-1

SMILES

CCCCCCCN(CCCCCCC)CCCCCCC

InChIKey

CLZGJKHEVKJLLS-UHFFFAOYSA-N

InChI

InChI=1S/C21H45N/c1-4-7-10-13-16-19-22(20-17-14-11-8-5-2)21-18-15-12-9-6-3/h4-21H2,1-3H3

Weigh it out

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

Names and synonyms

3 names

1-Heptanamine, N,N-diheptyl-
N,N-Diheptyl-1-heptanamine
Tri-n-heptylamine

Work with Triheptylamine

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

Trihexylamine102-86-3100 % similar Tridodecylamine102-87-4100 % similar Trioctylamine1116-76-3100 % similar Tripentylamine621-77-293 % similar 1-Butylpyrrolidine767-10-281 % similar Tributylamine102-82-975 % similar Stearyldiethanolamine10213-78-271 % similar Lauryldiethanolamine1541-67-971 % similar

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

Same formula

Didecylmethylamine7396-58-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook