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113962-24-6 | Stannane, octyltris[(1-oxopentyl)oxy]- (9CI)
CAS No: 113962-24-6 Catalog No: AG000A5Z MDL No:
Product Description
Catalog Number:
AG000A5Z
Chemical Name:
Stannane, octyltris[(1-oxopentyl)oxy]- (9CI)
CAS Number:
113962-24-6
Molecular Formula:
C23H44O6Sn
Molecular Weight:
535.2929
IUPAC Name:
[octyl-di(pentanoyloxy)stannyl] pentanoate
InChI:
InChI=1S/C8H17.3C5H10O2.Sn/c1-3-5-7-8-6-4-2;3*1-2-3-4-5(6)7;/h1,3-8H2,2H3;3*2-4H2,1H3,(H,6,7);/q;;;;+3/p-3
InChI Key:
HJUMTFTZJSYLFM-UHFFFAOYSA-K
SMILES:
CCCCCCCC[Sn](OC(=O)CCCC)(OC(=O)CCCC)OC(=O)CCCC
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.216g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
535.309g/mol
Monoisotopic Mass:
536.216g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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