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Dodecyltrimethylammonium chloride

CAT: 0063-87660455-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0063-87660455-01Size:25 g
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CAS Number
112-00-5

Chemical Information

Dodecyltrimethylammonium chloride

The CIR Expert Panel concluded the following ingredients are safe in the present practices of use and concentration described in the safety assessment when formulated to be non-irritating...Laurtrimonium Chloride...

CAS Number112-00-5
PubChem CID8152
IUPAC Namedodecyl(trimethyl)azanium chloride
Molecular FormulaC15H34ClN
Molecular Weight263.89
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count11
Heavy Atom Count17
Formal Charge0
Complexity135
SMILES
CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
InChI
InChI=1S/C15H34N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1
InChIKey
DDXLVDQZPFLQMZ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Dodecyltrimethylammonium chloride
CAS: 112-00-5
CID: 8152
Formula: C15H34ClN
MW: 263.89
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight263.89
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count11
Exact Mass263.2379778
Monoisotopic Mass263.2379778
Topological Polar Surface Area0 Ų
Heavy Atom Count17
Formal Charge0
Complexity135
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes