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Hexadecyltrimethylammonium perchlorate

CAT: 0931-TXB-00351-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-TXB-00351-01Size:100 mg
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CAS Number
6941-37-3
Bioactivity
Hexadecyltrimethylammonium perchlorate is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
O=Cl(=O)(=O)[O-].CCCCCCCCCCCCCCCC[N+](C)(C)C
Molecular Formula
C19H42ClNO4
Molecular Weight
383.99
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Hexadecyltrimethylammonium Perchlorate
CAS Number6941-37-3
PubChem CID15520692
IUPAC Namehexadecyl(trimethyl)azanium perchlorate
Molecular FormulaC19H42ClNO4
Molecular Weight384.0
Topological Polar Surface Area74.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count15
Heavy Atom Count25
Formal Charge0
Complexity277
SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)C.[O-]Cl(=O)(=O)=O
InChI
InChI=1S/C19H42N.ClHO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;2-1(3,4)5/h5-19H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChIKey
KXNZYPBRSATHKV-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Hexadecyltrimethylammonium Perchlorate
CAS: 6941-37-3
CID: 15520692
Formula: C19H42ClNO4
MW: 384.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight384.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count15
Exact Mass383.2802365
Monoisotopic Mass383.2802365
Topological Polar Surface Area74.3 Ų
Heavy Atom Count25
Formal Charge0
Complexity277
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