2-Butenedioic acid (2Z)-, 1,1'-(dibutylstannylene) 4,4'-diisooctyl ester
Typical physical and chemical properties |
Catalog Number |
ACM25168212-1 |
Product Name |
2-Butenedioic acid (2Z)-, 1,1'-(dibutylstannylene) 4,4'-diisooctyl ester |
CAS |
25168-21-2 |
Structure |
|
Synonyms |
Di-n-Butyl-bis-(2-ethylhexylmaleate)tin |
IUPAC Name |
4-O-[Dibutyl-[(Z)-4-(6-methylheptoxy)-4-oxobut-2-enoyl]oxystannyl] 1-O-(6-methylheptyl) (Z)-but-2-enedioate |
Molecular Weight |
687.5 |
Molecular Formula |
C32H56O8Sn |
Canonical SMILES |
CCCC[Sn](CCCC)(OC(=O)C=CC(=O)OCCCCCC(C)C)OC(=O)C=CC(=O)OCCCCCC(C)C |
InChI |
InChI=1S/2C12H20O4.2C4H9.Sn/c2*1-10(2)6-4-3-5-9-16-12(15)8-7-11(13)14;2*1-3-4-2;/h2*7-8,10H,3-6,9H2,1-2H3,(H,13,14);2*1,3-4H2,2H3;/q;+2/p-2/b2*8-7-; |
InChIKey |
VLQWDCKTDZZUSU-KKUWAICFSA-L |
Melting Point |
-25 °C |
Flash Point |
123 °C |
Complexity |
738 |
Covalently-Bonded Unit Count |
1 |
Defined Atom Stereocenter Count |
0 |
Defined Bond Stereocenter Count |
2 |
Exact Mass |
688.299721 |
Formal Charge |
0 |
Heavy Atom Count |
41 |
Hydrogen Bond Acceptor Count |
8 |
Hydrogen Bond Donor Count |
0 |
Isomeric SMILES |
CCCC[Sn](OC(=O)/C=C\C(=O)OCCCCCC(C)C)(OC(=O)/C=C\C(=O)OCCCCCC(C)C)CCCC |
Isotope Atom Count |
0 |
Monoisotopic Mass |
688.299721 |
Physical State |
Yellow oily liquid |
Rotatable Bond Count |
28 |
Topological Polar Surface Area |
105 Ų |
Undefined Atom Stereocenter Count |
0 |
Undefined Bond Stereocenter Count |
0 |
MSDS |
Download MSDS |
COA |
Download COA |
Spec Sheet |
Download Spec Sheet |
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