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Didodecyldimethylammonium bromide

CAT: 0063-15116738-25gSize: 25 gDry Ice: NoHazardous: No
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CAT#:0063-15116738-25gSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3282-73-3
Molecular Formula
C26H56BrN
Molecular Weight
462.63
Formulation
C26H56BrN

Chemical Information

Didodecyldimethylammonium bromide
CAS Number3282-73-3
PubChem CID18669
IUPAC Namedidodecyl(dimethyl)azanium bromide
Molecular FormulaC26H56BrN
Molecular Weight462.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count22
Heavy Atom Count28
Formal Charge0
Complexity245
SMILES
CCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC.[Br-]
InChI
InChI=1S/C26H56N.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27(3,4)26-24-22-20-18-16-14-12-10-8-6-2;/h5-26H2,1-4H3;1H/q+1;/p-1
InChIKey
XRWMGCFJVKDVMD-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Didodecyldimethylammonium bromide
CAS: 3282-73-3
CID: 18669
Formula: C26H56BrN
MW: 462.6
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight462.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count22
Exact Mass461.35961
Monoisotopic Mass461.35961
Topological Polar Surface Area0 Ų
Heavy Atom Count28
Formal Charge0
Complexity245
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