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Dioctyltin dilaurate

Catalog Number ACM3648188-2
CAS 3648-18-8
Structure Dioctyltin dilaurate
Synonyms Bis(lauroyloxy)dioctyltin
IUPAC Name [Dodecanoyloxy(dioctyl)stannyl] dodecanoate
Molecular Weight 743.8
Molecular Formula C40H80O4Sn
Canonical SMILES CCCCCCCCCCCC(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCCCCCC
InChI InChI=1S/2C12H24O2.2C8H17.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12(13)14;2*1-3-5-7-8-6-4-2;/h2*2-11H2,1H3,(H,13,14);2*1,3-8H2,2H3;/q;+2/p-2
InChI Key XQBCVRSTVUHIGH-UHFFFAOYSA-L
Boiling Point 647.5±24.0 °C
Melting Point 17-18°C
Flash Point 70 °C
Purity 95%
Complexity 584
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 0
Exact Mass 744.507864
Formal Charge 0
Heavy Atom Count 45
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
Monoisotopic Mass 744.507864
Rotatable Bond Count 38
Topological Polar Surface Area 52.6 Ų

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