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89412-44-2 | Stannane, iodomethylbis[[2,4,6-tris(1,1-dimethylethyl)phenyl]thio]-
CAS No: 89412-44-2 Catalog No: AG004400 MDL No:
Product Description
Catalog Number:
AG004400
Chemical Name:
Stannane, iodomethylbis[[2,4,6-tris(1,1-dimethylethyl)phenyl]thio]-
CAS Number:
89412-44-2
Molecular Formula:
C37H61IS2Sn
Molecular Weight:
815.6157
IUPAC Name:
iodomethyl-bis[(2,4,6-tritert-butylphenyl)sulfanyl]stannane
InChI:
InChI=1S/2C18H30S.CH2I.Sn.H/c2*1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9;1-2;;/h2*10-11,19H,1-9H3;1H2;;/q;;;+2;/p-2
InChI Key:
ACGXBOZZKJKZAC-UHFFFAOYSA-L
SMILES:
IC[SnH](Sc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)Sc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
Properties
Complexity:
710
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
816.228g/mol
Formal Charge:
0
Heavy Atom Count:
41
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
815.629g/mol
Monoisotopic Mass:
816.228g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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