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85702-85-8 | 1,3,5,2,4-Trioxadistannonane-6,9-dione,2,2,4,4-tetrabutyl-7-hydroxy-
CAS No: 85702-85-8 Catalog No: AG004ZLX MDL No:
Product Description
Catalog Number:
AG004ZLX
Chemical Name:
1,3,5,2,4-Trioxadistannonane-6,9-dione,2,2,4,4-tetrabutyl-7-hydroxy-
CAS Number:
85702-85-8
Molecular Formula:
C20H40O6Sn2
Molecular Weight:
613.9300
IUPAC Name:
2,2,4,4-tetrabutyl-7-hydroxy-1,3,5,2,4-trioxadistannonane-6,9-dione
InChI:
InChI=1S/C4H6O5.4C4H9.O.2Sn/c5-2(4(8)9)1-3(6)7;4*1-3-4-2;;;/h2,5H,1H2,(H,6,7)(H,8,9);4*1,3-4H2,2H3;;;/q;;;;;;2*+1/p-2
InChI Key:
MYSOUECRFAEIOD-UHFFFAOYSA-L
SMILES:
CCCC[Sn]1(CCCC)OC(=O)CC(C(=O)O[Sn](O1)(CCCC)CCCC)O
EC Number:
288-277-6
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
614.086g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
613.954g/mol
Monoisotopic Mass:
616.087g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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