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116178-88-2 | 1,3,6,2-Trioxastannocane-4,8-dione, 2,2-dimethyl-
CAS No: 116178-88-2 Catalog No: AG000BTJ MDL No:
Product Description
Catalog Number:
AG000BTJ
Chemical Name:
1,3,6,2-Trioxastannocane-4,8-dione, 2,2-dimethyl-
CAS Number:
116178-88-2
Molecular Formula:
C6H10O5Sn
Molecular Weight:
280.8416
IUPAC Name:
2,2-dimethyl-1,3,6,2-trioxastannocane-4,8-dione
InChI:
InChI=1S/C4H6O5.2CH3.Sn/c5-3(6)1-9-2-4(7)8;;;/h1-2H2,(H,5,6)(H,7,8);2*1H3;/q;;;+2/p-2
InChI Key:
XUADOHNLRMSNDI-UHFFFAOYSA-L
SMILES:
O=C1COCC(=O)O[Sn](O1)(C)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.955g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.851g/mol
Monoisotopic Mass:
281.955g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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