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Chemical Product CAS:10039-33-55,7,12-Trioxa-6-stannaoctadeca-2,9-dienoicacid, 14-ethyl-6,6-dioctyl-4,8,11-trioxo-, 2-ethylhexyl ester

CAS:10039-33-5
5,7,12-Trioxa-6-stannaoctadeca-2,9-dienoicacid, 14-ethyl-6,6-dioctyl-4,8,11-trioxo-, 2-ethylhexyl ester

  • CAS No:

    10039-33-5
  • Name:

    5,7,12-Trioxa-6-stannaoctadeca-2,9-dienoicacid, 14-ethyl-6,6-dioctyl-4,8,11-trioxo-, 2-ethylhexyl ester
  • Molecular Formula:

    C40H72 O8 Sn
  • Molecular Weight:

    799.81
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5,7,12-Trioxa-6-stannaoctadeca-2,9-dienoicaci ( CASNO:10039-33-5 )

Identification and Related Records
Name:
5,7,12-Trioxa-6-stannaoctadeca-2,9-dienoicacid, 14-ethyl-6,6-dioctyl-4,8,11-trioxo-, 2-ethylhexyl ester
CAS Registry number:
10039-33-5
Synonyms:
Stannane,bis[(3-carboxyacryloyl)oxy]dioctyl-, bis(2-ethylhexyl) ester (8CI)
Tin,bis[(3-carboxyacryloyl)oxy]dioctyl-, bis(2-ethylhexyl) ester (7CI)
Maleicacid, mono(2-ethylhexyl) ester, dioctylstannylene deriv. (8CI)
2-Ethylhexyl14-ethyl-6,6-dioctyl-4,8,11-trioxo-5,7,12-trioxa-6-stannaoctadeca-2,9-dienoate
Di-n-octyltin bis(2-ethylhexyl maleate)
Dioctyltin bis(2-ethylhexyl maleate)
Thermolite 825
EINECS(EC#):
233-117-2
Molecular Formula:
C40H72 O8 Sn
Molecular Weight:
799.81
Inchi:
InChI=1/2C12H20O4.2C8H17.Sn/c2*1-3-5-6-10(4-2)9-16-12(15)8-7-11(13)14;2*1-3-5-7-8-6-4-2;/h2*7-8,10H,3-6,9H2,1-2H3,(H,13,14);2*1,3-8H2,2H3;/q;;;;+2/p-2/rC40H72O8Sn/c1-7-13-17-19-21-23-31-49(32-24-22-20-18-14-8-2,47-39(43)29-27-37(41)45-33-35(11-5)25-15-9-3)48-40(44)30-28-38(42)46-34-36(12-6)26-16-10-4/h27-30,35-36H,7-26,31-34H2,1-6H3
Canonical SMILES:
CCCCCCCC[Sn](CCCCCCCC)(OC(=O)C=CC(=O)OCC(CC)CCCC)OC(=O)C=CC(=O)OCC(CC)CCCC
Isomers smiles:
CCCCCCCC[Sn](OC(=O)/C=C/C(=O)OCC(CCCC)CC)(OC(=O)/C=C/C(=O)OCC(CCCC)CC)
CCCCCCCC
Chemical and Physical Properties
Density:
g/cm3
Boiling Point:
°Cat760mmHg
Vapour:
2.06E-19mmHg at 25°C
Flash Point:
°C
Computed Properties:
Molecular Weight:799.70488 [g/mol]
Molecular Formula:C40H72O8Sn
H-Bond Donor:0
H-Bond Acceptor:8
Rotatable Bond Count:36
Exact Mass:800.424916
MonoIsotopic Mass:800.424916
Topological Polar Surface Area:105
Heavy Atom Count:49
Formal Charge:0
Complexity:857
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:2
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Safety and Handling
Hazard Codes:
Moderately toxic by ingestion. TWA 0.1 mg(Sn)/m3; STEL 0.2 mg(Sn)/m3 (skin).
Safety Statements:
Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also TIN COMPOUNDS.Analytical Methods:   For occupational chemical analysis use NIOSH: Organotin Compounds 5504.
Safety:
Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also TIN COMPOUNDS.    

Analytical Methods:        

For occupational chemical analysis use NIOSH: Organotin Compounds 5504.

Specification:
 Di-n-octyltin bis(2-ethylhexyl maleate) ,its cas register number is 10039-33-5. It also can be called Di-n-octyl-zinn-bis(2-aethylhexylmaleinat) ; Tin, bis(hydrogen maleato)dioctyl-, bis(2-ethylhexyl) ester ; 5,7,12-Trioxa-6-stannaoctadeca-2,9-dienoic acid, 14-ethyl-6,6-dioctyl-4,8,11-trioxo-, 2-ethylhexyl ester ;and Dioctyltin bis(2-ethylhexyl maleate) .
Report:
Reported in EPA TSCA Inventory.
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