trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane

C13H20SSn — CID 71654607

IUPACtrimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane
SMILESC[Sn](C)(C)c1scc2c1C1CCC2CC1
InChIInChI=1S/C10H11S.3CH3.Sn/c1-2-8-4-3-7(1)9-5-11-6-10(8)9;;;;/h5,7-8H,1-4H2;3*1H3;
InChIKeyVEDWABZJYWGSGH-UHFFFAOYSA-N
MW327.08 g/mol
LogP4.05
Rot. Bonds1

About trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane

trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane (PubChem CID 71654607) has the molecular formula C13H20SSn and a molecular weight of 327.08 g/mol. Its IUPAC name is trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane.

Molecular Properties

Compound Nametrimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane
PubChem CID71654607
Molecular FormulaC13H20SSn
Molecular Weight327.08 g/mol
Exact Mass328.03
IUPAC Nametrimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane
SMILESC[Sn](C)(C)c1scc2c1C1CCC2CC1
InChIInChI=1S/C10H11S.3CH3.Sn/c1-2-8-4-3-7(1)9-5-11-6-10(8)9;;;;/h5,7-8H,1-4H2;3*1H3;
InChIKeyVEDWABZJYWGSGH-UHFFFAOYSA-N
XLogP4.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.08
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane?
The IUPAC name of trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane (CID 71654607) is trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane.
What is the SMILES notation for trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane?
The canonical SMILES for trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane is C[Sn](C)(C)c1scc2c1C1CCC2CC1.
What is the InChIKey of trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane?
The InChIKey is VEDWABZJYWGSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11S.3CH3.Sn/c1-2-8-4-3-7(1)9-5-11-6-10(8)9;;;;/h5,7-8H,1-4H2;3*1H3;.
What are the key properties of trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane?
trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane has a molecular weight of 327.08 g/mol, XLogP of 4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane is sourced from PubChem (CID 71654607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).