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7630-40-2 | 1,3,5-Triazine, 2,4,6-tris[(tributylstannyl)thio]-
CAS No: 7630-40-2 Catalog No: AG005E7A MDL No:
Product Description
Catalog Number:
AG005E7A
Chemical Name:
1,3,5-Triazine, 2,4,6-tris[(tributylstannyl)thio]-
CAS Number:
7630-40-2
Molecular Formula:
C39H81N3S3Sn3
Molecular Weight:
1044.3785
IUPAC Name:
[4,6-bis(tributylstannylsulfanyl)-1,3,5-triazin-2-yl]sulfanyl-tributylstannane
InChI:
InChI=1S/9C4H9.C3H3N3S3.3Sn/c9*1-3-4-2;7-1-4-2(8)6-3(9)5-1;;;/h9*1,3-4H2,2H3;(H3,4,5,6,7,8,9);;;/q;;;;;;;;;;3*+1/p-3
InChI Key:
QHOBWUFYEPVAOA-UHFFFAOYSA-K
SMILES:
CCCC[Sn](Sc1nc(nc(n1)S[Sn](CCCC)(CCCC)CCCC)S[Sn](CCCC)(CCCC)CCCC)(CCCC)CCCC
Properties
Complexity:
578
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1045.265g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1044.408g/mol
Monoisotopic Mass:
1047.266g/mol
Rotatable Bond Count:
33
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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