sulfane;bis(tributyl(phenyl)stannane)

C36H66SSn2 — CID 67835272

IUPACsulfane;bis(tributyl(phenyl)stannane)
SMILESCCCC[Sn](CCCC)(CCCC)c1ccccc1.CCCC[Sn](CCCC)(CCCC)c1ccccc1.S
InChIInChI=1S/2C6H5.6C4H9.H2S.2Sn/c2*1-2-4-6-5-3-1;6*1-3-4-2;;;/h2*1-5H;6*1,3-4H2,2H3;1H2;;
InChIKeyLMEMYXUWCOCCJE-UHFFFAOYSA-N
MW768.41 g/mol
LogP11.60
Rot. Bonds20

About sulfane;bis(tributyl(phenyl)stannane)

sulfane;bis(tributyl(phenyl)stannane) (PubChem CID 67835272) has the molecular formula C36H66SSn2 and a molecular weight of 768.41 g/mol. Its IUPAC name is sulfane;bis(tributyl(phenyl)stannane).

Molecular Properties

Compound Namesulfane;bis(tributyl(phenyl)stannane)
PubChem CID67835272
Molecular FormulaC36H66SSn2
Molecular Weight768.41 g/mol
Exact Mass770.29
IUPAC Namesulfane;bis(tributyl(phenyl)stannane)
SMILESCCCC[Sn](CCCC)(CCCC)c1ccccc1.CCCC[Sn](CCCC)(CCCC)c1ccccc1.S
InChIInChI=1S/2C6H5.6C4H9.H2S.2Sn/c2*1-2-4-6-5-3-1;6*1-3-4-2;;;/h2*1-5H;6*1,3-4H2,2H3;1H2;;
InChIKeyLMEMYXUWCOCCJE-UHFFFAOYSA-N
XLogP11.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds20
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500768.41
LogP ≤ 511.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

fluoro(triphenyl)stannane;tributyl(fluoro)stannane
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tributyl-(4-methoxyphenyl)stannane
CID 2762547
tributyl(phenanthridin-6-yl)stannane
CID 171832720
tributyl-(3-methylsulfanylphenyl)stannane
CID 90487814
N,N-diphenyl-5-tributylstannylfuran-2-amine
CID 152704451
tributyl-(4-phenyl-2-pyridinyl)stannane
CID 67508437
dibenzyl-butyl-chlorostannane
CID 14517512
tributyl-[(S)-deuterio(phenyl)methyl]stannane
CID 138962774
decane;sulfane;toluene
CID 157105742
1-benzofuran-2-yl(tributyl)stannane
CID 3825856
dibutyl-(2-methylbut-3-en-2-yl)-phenylstannane
CID 10619687
tributyl-(2-phenyl-1,3-oxazol-5-yl)stannane
CID 10646461

Frequently Asked Questions

What is the IUPAC name of sulfane;bis(tributyl(phenyl)stannane)?
The IUPAC name of sulfane;bis(tributyl(phenyl)stannane) (CID 67835272) is sulfane;bis(tributyl(phenyl)stannane).
What is the SMILES notation for sulfane;bis(tributyl(phenyl)stannane)?
The canonical SMILES for sulfane;bis(tributyl(phenyl)stannane) is CCCC[Sn](CCCC)(CCCC)c1ccccc1.CCCC[Sn](CCCC)(CCCC)c1ccccc1.S.
What is the InChIKey of sulfane;bis(tributyl(phenyl)stannane)?
The InChIKey is LMEMYXUWCOCCJE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H5.6C4H9.H2S.2Sn/c2*1-2-4-6-5-3-1;6*1-3-4-2;;;/h2*1-5H;6*1,3-4H2,2H3;1H2;;.
What are the key properties of sulfane;bis(tributyl(phenyl)stannane)?
sulfane;bis(tributyl(phenyl)stannane) has a molecular weight of 768.41 g/mol, XLogP of 11.60, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sulfane;bis(tributyl(phenyl)stannane) is sourced from PubChem (CID 67835272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).