tributyl(oct-1-en-2-yl)stannane

C20H42Sn — CID 14660627

IUPACtributyl(oct-1-en-2-yl)stannane
SMILESC=C(CCCCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C8H15.3C4H9.Sn/c1-3-5-7-8-6-4-2;3*1-3-4-2;/h1,4-8H2,2H3;3*1,3-4H2,2H3;
InChIKeySUIRBZFCEGVEIO-UHFFFAOYSA-N
MW401.27 g/mol
LogP7.90
Rot. Bonds15

About tributyl(oct-1-en-2-yl)stannane

tributyl(oct-1-en-2-yl)stannane (PubChem CID 14660627) has the molecular formula C20H42Sn and a molecular weight of 401.27 g/mol. Its IUPAC name is tributyl(oct-1-en-2-yl)stannane.

Molecular Properties

Compound Nametributyl(oct-1-en-2-yl)stannane
PubChem CID14660627
Molecular FormulaC20H42Sn
Molecular Weight401.27 g/mol
Exact Mass402.23
IUPAC Nametributyl(oct-1-en-2-yl)stannane
SMILESC=C(CCCCCC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C8H15.3C4H9.Sn/c1-3-5-7-8-6-4-2;3*1-3-4-2;/h1,4-8H2,2H3;3*1,3-4H2,2H3;
InChIKeySUIRBZFCEGVEIO-UHFFFAOYSA-N
XLogP7.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.27
LogP ≤ 57.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tributyl(oct-1-en-2-yl)stannane?
The IUPAC name of tributyl(oct-1-en-2-yl)stannane (CID 14660627) is tributyl(oct-1-en-2-yl)stannane.
What is the SMILES notation for tributyl(oct-1-en-2-yl)stannane?
The canonical SMILES for tributyl(oct-1-en-2-yl)stannane is C=C(CCCCCC)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(oct-1-en-2-yl)stannane?
The InChIKey is SUIRBZFCEGVEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15.3C4H9.Sn/c1-3-5-7-8-6-4-2;3*1-3-4-2;/h1,4-8H2,2H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl(oct-1-en-2-yl)stannane?
tributyl(oct-1-en-2-yl)stannane has a molecular weight of 401.27 g/mol, XLogP of 7.90, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(oct-1-en-2-yl)stannane is sourced from PubChem (CID 14660627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).