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Tetradodecylammonium bromide

CAT: 0024-sc-237030Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-237030Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
14866-34-3

Chemical Information

Tetradodecylammonium bromide
CAS Number14866-34-3
PubChem CID3014871
IUPAC Nametetradodecylazanium bromide
Molecular FormulaC48H100BrN
Molecular Weight771.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count44
Heavy Atom Count50
Formal Charge0
Complexity468
SMILES
CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)CCCCCCCCCCCC.[Br-]
InChI
InChI=1S/C48H100N.BrH/c1-5-9-13-17-21-25-29-33-37-41-45-49(46-42-38-34-30-26-22-18-14-10-6-2,47-43-39-35-31-27-23-19-15-11-7-3)48-44-40-36-32-28-24-20-16-12-8-4;/h5-48H2,1-4H3;1H/q+1;/p-1
InChIKey
SMEFTBPJZGVAPK-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Tetradodecylammonium bromide
CAS: 14866-34-3
CID: 3014871
Formula: C48H100BrN
MW: 771.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight771.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count44
Exact Mass769.70391
Monoisotopic Mass769.70391
Topological Polar Surface Area0 Ų
Heavy Atom Count50
Formal Charge0
Complexity468
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

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Alternative Products

CatalogName
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AR-R11297-01Rocuronium Bromide Impurity 7 Bromide
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