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125769-73-5 | 2-Propenamide, 3-(phenylsulfinyl)-3-(tributylstannyl)-, (Z)- (9CI)
CAS No: 125769-73-5 Catalog No: AG000OP1 MDL No:
Product Description
Catalog Number:
AG000OP1
Chemical Name:
2-Propenamide, 3-(phenylsulfinyl)-3-(tributylstannyl)-, (Z)- (9CI)
CAS Number:
125769-73-5
Molecular Formula:
C21H35NO2SSn
Molecular Weight:
484.2741
IUPAC Name:
3-(benzenesulfinyl)-3-tributylstannylprop-2-enamide
InChI:
InChI=1S/C9H8NO2S.3C4H9.Sn/c10-9(11)6-7-13(12)8-4-2-1-3-5-8;3*1-3-4-2;/h1-6H,(H2,10,11);3*1,3-4H2,2H3;
InChI Key:
VOXWCCZITQEQDF-UHFFFAOYSA-N
SMILES:
CCCC[Sn](/C(=C\C(=O)N)/S(=O)c1ccccc1)(CCCC)CCCC
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.141g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
484.286g/mol
Monoisotopic Mass:
485.141g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
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