2-cyclohexylsulfonylethyl(trimethyl)stannane

C11H24O2SSn — CID 12901388

IUPAC2-cyclohexylsulfonylethyl(trimethyl)stannane
SMILESC[Sn](C)(C)CCS(=O)(=O)C1CCCCC1
InChIInChI=1S/C8H15O2S.3CH3.Sn/c1-2-11(9,10)8-6-4-3-5-7-8;;;;/h8H,1-7H2;3*1H3;
InChIKeyMPTUMPYSRMLFGU-UHFFFAOYSA-N
MW339.09 g/mol
LogP3.07
Rot. Bonds4

About 2-cyclohexylsulfonylethyl(trimethyl)stannane

2-cyclohexylsulfonylethyl(trimethyl)stannane (PubChem CID 12901388) has the molecular formula C11H24O2SSn and a molecular weight of 339.09 g/mol. Its IUPAC name is 2-cyclohexylsulfonylethyl(trimethyl)stannane.

Molecular Properties

Compound Name2-cyclohexylsulfonylethyl(trimethyl)stannane
PubChem CID12901388
Molecular FormulaC11H24O2SSn
Molecular Weight339.09 g/mol
Exact Mass340.05
IUPAC Name2-cyclohexylsulfonylethyl(trimethyl)stannane
SMILESC[Sn](C)(C)CCS(=O)(=O)C1CCCCC1
InChIInChI=1S/C8H15O2S.3CH3.Sn/c1-2-11(9,10)8-6-4-3-5-7-8;;;;/h8H,1-7H2;3*1H3;
InChIKeyMPTUMPYSRMLFGU-UHFFFAOYSA-N
XLogP3.07
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.09
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylsulfonylethyl(trimethyl)stannane?
The IUPAC name of 2-cyclohexylsulfonylethyl(trimethyl)stannane (CID 12901388) is 2-cyclohexylsulfonylethyl(trimethyl)stannane.
What is the SMILES notation for 2-cyclohexylsulfonylethyl(trimethyl)stannane?
The canonical SMILES for 2-cyclohexylsulfonylethyl(trimethyl)stannane is C[Sn](C)(C)CCS(=O)(=O)C1CCCCC1.
What is the InChIKey of 2-cyclohexylsulfonylethyl(trimethyl)stannane?
The InChIKey is MPTUMPYSRMLFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15O2S.3CH3.Sn/c1-2-11(9,10)8-6-4-3-5-7-8;;;;/h8H,1-7H2;3*1H3;.
What are the key properties of 2-cyclohexylsulfonylethyl(trimethyl)stannane?
2-cyclohexylsulfonylethyl(trimethyl)stannane has a molecular weight of 339.09 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylsulfonylethyl(trimethyl)stannane is sourced from PubChem (CID 12901388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).