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30860-66-3 | Pyridine, 2-[(tributylstannyl)thio]-, 1-oxide
CAS No: 30860-66-3 Catalog No: AG0031IO MDL No:
Product Description
Catalog Number:
AG0031IO
Chemical Name:
Pyridine, 2-[(tributylstannyl)thio]-, 1-oxide
CAS Number:
30860-66-3
Molecular Formula:
C17H31NOSSn
Molecular Weight:
416.2001
IUPAC Name:
tributyl-(1-oxidopyridin-1-ium-2-yl)sulfanylstannane
InChI:
InChI=1S/C5H5NOS.3C4H9.Sn/c7-6-4-2-1-3-5(6)8;3*1-3-4-2;/h1-4,8H;3*1,3-4H2,2H3;/q;;;;+1/p-1
InChI Key:
IZLTYRKHPKGVOT-UHFFFAOYSA-M
SMILES:
CCCC[Sn](Sc1cccc[n+]1[O-])(CCCC)CCCC
EC Number:
250-362-0
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.115g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
416.211g/mol
Monoisotopic Mass:
417.115g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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