Einecs 272-467-0 structure

Einecs 272-467-0

(Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)octadec-9-enamide;phosphoric acid;tridecan-1-ol

Also Known As: EINECS 272-467-0|9-Octadecenamide, N-(2-aminoethyl)-N-(2-hydroxyethyl)-, (9Z)-, compd. with 1-tridecanol phosphate|Phosphoric acid, tridecyl ester, compd. with (Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)-9-octadecenamide|(Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)octadec-9-enamide; phosphoric acid; tridecan-1-ol|9-Octadecenamide, N-(2-aminoethyl)-N-(2-hydroxyethyl)-, (Z)-, compd. with 1-tridecanol phosphate|Phosphoric acid, tridecyl ester, compound with (Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)-9-octadecenamide

CAS: 68845-40-9
Molecular Formula C35H75N2O7P
Molecular Weight 666.5312 g/mol
LogP 8.1646
Topological Polar Surface Area 164.55 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 5
Rotatable Bonds 30
Exact Mass 666.5312
Monoisotopic Mass 666.5312
Heavy Atoms 45
Complexity 621.2202

Chemical Identifiers

CAS Number 68845-40-9
SMILES CCCCCCCCCCCCCO.CCCCCCCC/C=C\CCCCCCCC(=O)N(CCN)CCO.OP(=O)(O)O

Product Overview

Einecs 272-467-0 (CAS 68845-40-9), with molecular formula C35H75N2O7P and molecular weight 666.5312 g/mol. IUPAC: (Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)octadec-9-enamide;phosphoric acid;tridecan-1-ol.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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