AC1O5VWJ structure

AC1O5VWJ

3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine;bis((9Z,12Z)-octadeca-9,12-dienoic acid)

Also Known As: ((C18-H32-O2)2.C10-H24-N2-O3)x-|3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine; (9Z,12Z)-octadeca-9,12-dienoic Acid|9,12-Octadecadienoic acid (9Z,12Z)-, dimer, polymer with 3,3'-[oxybis(2,1-ethanediyloxy)]bis[1-propanamine]|9,12-Octadecadienoic acid (9Z,12Z)-, dimer, polymer with 3,3'-(oxybis(2,1-ethanediyloxy))bis(1-propanamine)|9,12-Octadecadienoic acid (9Z,12Z)-, dimer, polymer with 3,3-oxybis(2,1-ethanediyloxy)bis1-propanami|9,12-Octadecadienoic acid (Z,Z)-, dimer, polymer with 3,3'-[oxybis(2,1-ethanediyloxy)]bis[1-propanamine]|9,12-Octadecadienoic acid (Z,Z)-, polymer with 3,3'-[oxybis(2,1-ethanediyloxy)]bis[1-propanamine]|9,12-Octadecadienoic acid, (Z,Z)-, dimer, polymer with 3,3'-[oxybis(2,1-ethanediyloxy)]bis[1-propanamine]

CAS: 68541-13-9
Molecular Formula C46H88N2O7
Molecular Weight 780.6592 g/mol
LogP 11.5028
Topological Polar Surface Area 154.33 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 40
Exact Mass 780.6592
Monoisotopic Mass 780.6592
Heavy Atoms 55
Complexity 793.2158

Chemical Identifiers

CAS Number 68541-13-9
SMILES CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(COCCOCCOCCCN)CN

Product Overview

AC1O5VWJ (CAS 68541-13-9), with molecular formula C46H88N2O7 and molecular weight 780.6592 g/mol. IUPAC: 3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine;bis((9Z,12Z)-octadeca-9,12-dienoic acid).

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