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123280-32-0 | Benzoic acid, 1,1'-(1,1,3,3-tetrabutyl-1,3-distannoxanediyl) ester
CAS No: 123280-32-0 Catalog No: AG000K9F MDL No:
Product Description
Catalog Number:
AG000K9F
Chemical Name:
Benzoic acid, 1,1'-(1,1,3,3-tetrabutyl-1,3-distannoxanediyl) ester
CAS Number:
123280-32-0
Molecular Formula:
C30H46O5Sn2
Molecular Weight:
724.0852
IUPAC Name:
[[benzoyloxy(dibutyl)stannyl]oxy-dibutylstannyl] benzoate
InChI:
InChI=1S/2C7H6O2.4C4H9.O.2Sn/c2*8-7(9)6-4-2-1-3-5-6;4*1-3-4-2;;;/h2*1-5H,(H,8,9);4*1,3-4H2,2H3;;;/q;;;;;;;2*+1/p-2
InChI Key:
IJQVWOFSFLHPCW-UHFFFAOYSA-L
SMILES:
CCCC[Sn](O[Sn](OC(=O)c1ccccc1)(CCCC)CCCC)(OC(=O)c1ccccc1)CCCC
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
724.138g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
724.113g/mol
Monoisotopic Mass:
726.139g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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