tributyl-[(E)-2-cyclohexylethenyl]stannane

C20H40Sn — CID 10862246

IUPACtributyl-[(E)-2-cyclohexylethenyl]stannane
SMILESCCCC[Sn](/C=C/C1CCCCC1)(CCCC)CCCC
InChIInChI=1S/C8H13.3C4H9.Sn/c1-2-8-6-4-3-5-7-8;3*1-3-4-2;/h1-2,8H,3-7H2;3*1,3-4H2,2H3;
InChIKeySSWKDDXPBMUSLF-UHFFFAOYSA-N
MW399.25 g/mol
LogP7.51
Rot. Bonds11

About tributyl-[(E)-2-cyclohexylethenyl]stannane

tributyl-[(E)-2-cyclohexylethenyl]stannane (PubChem CID 10862246) has the molecular formula C20H40Sn and a molecular weight of 399.25 g/mol. Its IUPAC name is tributyl-[(E)-2-cyclohexylethenyl]stannane.

Molecular Properties

Compound Nametributyl-[(E)-2-cyclohexylethenyl]stannane
PubChem CID10862246
Molecular FormulaC20H40Sn
Molecular Weight399.25 g/mol
Exact Mass400.22
IUPAC Nametributyl-[(E)-2-cyclohexylethenyl]stannane
SMILESCCCC[Sn](/C=C/C1CCCCC1)(CCCC)CCCC
InChIInChI=1S/C8H13.3C4H9.Sn/c1-2-8-6-4-3-5-7-8;3*1-3-4-2;/h1-2,8H,3-7H2;3*1,3-4H2,2H3;
InChIKeySSWKDDXPBMUSLF-UHFFFAOYSA-N
XLogP7.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.25
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tributyl-[(E)-2-cyclohexylethenyl]stannane?
The IUPAC name of tributyl-[(E)-2-cyclohexylethenyl]stannane (CID 10862246) is tributyl-[(E)-2-cyclohexylethenyl]stannane.
What is the SMILES notation for tributyl-[(E)-2-cyclohexylethenyl]stannane?
The canonical SMILES for tributyl-[(E)-2-cyclohexylethenyl]stannane is CCCC[Sn](/C=C/C1CCCCC1)(CCCC)CCCC.
What is the InChIKey of tributyl-[(E)-2-cyclohexylethenyl]stannane?
The InChIKey is SSWKDDXPBMUSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13.3C4H9.Sn/c1-2-8-6-4-3-5-7-8;3*1-3-4-2;/h1-2,8H,3-7H2;3*1,3-4H2,2H3;.
What are the key properties of tributyl-[(E)-2-cyclohexylethenyl]stannane?
tributyl-[(E)-2-cyclohexylethenyl]stannane has a molecular weight of 399.25 g/mol, XLogP of 7.51, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(E)-2-cyclohexylethenyl]stannane is sourced from PubChem (CID 10862246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).