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84040-81-3 | Sulfonium, dimethyloctadecyl-, iodide
CAS No: 84040-81-3 Catalog No: AG004U63 MDL No:
Product Description
Catalog Number:
AG004U63
Chemical Name:
Sulfonium, dimethyloctadecyl-, iodide
CAS Number:
84040-81-3
Molecular Formula:
C20H43IS
Molecular Weight:
442.5249
IUPAC Name:
dimethyl(octadecyl)sulfanium;iodide
InChI:
InChI=1S/C20H43S.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3;/h4-20H2,1-3H3;1H/q+1;/p-1
InChI Key:
AZFBXGUXCLXDSF-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCCC[S+](C)C.[I-]
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.213g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
442.528g/mol
Monoisotopic Mass:
442.213g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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