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CAS No.: | 50788-67-5 |
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Name: | diisooctyl 3,3'-[(dioctylstannylene)bis(thio)]dipropionate |
Molecular Structure: | |
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Formula: | C38H76O4S2Sn |
Molecular Weight: | 779.8476 |
Synonyms: | Dioctyltinbis(isooctylb-mercaptopropionate);Diisooctyl 3,3'-((dioctylstannylene)bis(thio))dipropionate; |
EINECS: | 256-762-1 |
PSA: | 52.60000 |
LogP: | 11.34720 |
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The Propanoic acid,3,3'-[(dioctylstannylene)bis(thio)]bis-, diisooctyl ester (9CI), with the CAS registry number 50788-67-5, is also known as Diisooctyl 3,3'-((dioctylstannylene)bis(thio))dipropionate. Its EINECS registry number is 256-762-1. This chemical's molecular formula is C38H76O4S2Sn and molecular weight is 779.8476. What's more, its IUPAC name is 6-Methylheptyl 3-[[3-(6-methylheptoxy)-3-oxopropyl]sulfanyl-dioctylstannyl]sulfanylpropanoate.
Physical properties about Propanoic acid,3,3'-[(dioctylstannylene)bis(thio)]bis-, diisooctyl ester (9CI) are: (1)#H bond acceptors: 0; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 14; (4)Polar Surface Area: 0 Å2.
You can still convert the following datas into molecular structure:
(1) SMILES: [S-]CCC(=O)OCCCCCC(C)C.[S-]CCC(=O)OCCCCCC(C)C.[Sn+2](CCCCCCCC)CCCCCCCC
(2) InChI: InChI=1/2C11H22O2S.2C8H17.Sn/c2*1-10(2)6-4-3-5-8-13-11(12)7-9-14;2*1-3-5-7-8-6-4-2;/h2*10,14H,3-9H2,1-2H3;2*1,3-8H2,2H3;/q;;;;+2/p-2/rC16H34Sn.2C11H22O2S/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;2*1-10(2)6-4-3-5-8-13-11(12)7-9-14/h3-16H2,1-2H3;2*10,14H,3-9H2,1-2H3/q+2;;/p-2
(3) InChIKey: DLSNCIMATOOTPT-HSDRUCHSAK