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QX 222

CAT: 0024-sc-203673Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-203673Size:10 mg
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CAS Number
21236-55-5

Chemical Information

QX-222

[2-(2,6-dimethylanilino)-2-oxoethyl]-trimethylammonium is an amino acid amide.

CAS Number21236-55-5
PubChem CID5014
IUPAC Name[2-(2,6-dimethylanilino)-2-oxoethyl]-trimethylazanium
Molecular FormulaC13H21N2O+
Molecular Weight221.32
XLogP1.4
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge1
Complexity235
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)C
InChI
InChI=1S/C13H20N2O/c1-10-7-6-8-11(2)13(10)14-12(16)9-15(3,4)5/h6-8H,9H2,1-5H3/p+1
InChIKey
QYUXPWDVDMSTKR-UHFFFAOYSA-O
Chemical Structure
2D Structure
2D structure of QX-222
CAS: 21236-55-5
CID: 5014
Formula: C13H21N2O+
MW: 221.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight221.32
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass221.165388298
Monoisotopic Mass221.165388298
Topological Polar Surface Area29.1 Ų
Heavy Atom Count16
Formal Charge1
Complexity235
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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