3-[dimethyl-[3-(tetradecanoylamino)propyl]azaniumyl]propane-1-sulfonate


Chemical Name: 3-[dimethyl-[3-(tetradecanoylamino)propyl]azaniumyl]propane-1-sulfonate
CAS Number: 216667-08-2
Product Number: AG007PGW(AGN-PC-0L4EAN)
Synonyms:
MDL No: MFCD03456122
Molecular Formula: C22H46N2O4S
Molecular Weight: 434.6766

Identification/Properties


Computed Properties
Molecular Weight:
434.68g/mol
XLogP3:
5.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
19
Exact Mass:
434.318g/mol
Monoisotopic Mass:
434.318g/mol
Topological Polar Surface Area:
94.7A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
488
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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