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Benzyldimethyldodecylammonium chloride

Catalog DGS139071
CAS 139-07-1
Structure
Synonyms Dodecyldimethylbenzylammonium chloride; N-Dodecyl-N,N-dimethyl-benzenemethanaminium chloride
IUPAC Name benzyl-dodecyl-dimethylazanium;chloride
Molecular Weight 339.99
Molecular Formula C21H38ClN
InChI InChI=1S/C21H38N.ClH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1
InChI Key JBIROUFYLSSYDX-UHFFFAOYSA-M
Melting Point 60 °C
Purity 99%
Appearance White fine crystalline powder
Complexity 240
EC Number 205-351-5
Exact Mass 339.2692779
Formal Charge 0
Heavy Atom Count 23
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
Isomeric SMILES CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]
Monoisotopic Mass 339.2692779
Rotatable Bond Count 13
Topological Polar Surface Area 0 Ų

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