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123061-49-4 | Pyrimidine, 2-(methylthio)-4-(tributylstannyl)-
CAS No: 123061-49-4 Catalog No: AG000K0C MDL No:MFCD01319026
Product Description
Catalog Number:
AG000K0C
Chemical Name:
Pyrimidine, 2-(methylthio)-4-(tributylstannyl)-
CAS Number:
123061-49-4
Molecular Formula:
C17H32N2SSn
Molecular Weight:
415.2154
MDL Number:
MFCD01319026
IUPAC Name:
tributyl-(2-methylsulfanylpyrimidin-4-yl)stannane
InChI:
InChI=1S/C5H5N2S.3C4H9.Sn/c1-8-5-6-3-2-4-7-5;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3;
InChI Key:
PTONZGYJJBJAGZ-UHFFFAOYSA-N
SMILES:
CCCC[Sn](c1ccnc(n1)SC)(CCCC)CCCC
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.131g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
415.227g/mol
Monoisotopic Mass:
416.131g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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