tributyl(prop-1-ynyl)stannane

C15H30Sn — CID 2733165

IUPACtributyl(prop-1-ynyl)stannane
SMILESCC#C[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/3C4H9.C3H3.Sn/c3*1-3-4-2;1-3-2;/h3*1,3-4H2,2H3;1H3;
InChIKeyKCQJLTOSSVXOCC-UHFFFAOYSA-N
MW329.12 g/mol
LogP5.40
Rot. Bonds9

About tributyl(prop-1-ynyl)stannane

tributyl(prop-1-ynyl)stannane (PubChem CID 2733165) has the molecular formula C15H30Sn and a molecular weight of 329.12 g/mol. Its IUPAC name is tributyl(prop-1-ynyl)stannane.

Molecular Properties

Compound Nametributyl(prop-1-ynyl)stannane
PubChem CID2733165
Molecular FormulaC15H30Sn
Molecular Weight329.12 g/mol
Exact Mass330.14
IUPAC Nametributyl(prop-1-ynyl)stannane
SMILESCC#C[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/3C4H9.C3H3.Sn/c3*1-3-4-2;1-3-2;/h3*1,3-4H2,2H3;1H3;
InChIKeyKCQJLTOSSVXOCC-UHFFFAOYSA-N
XLogP5.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.12
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tributyl(prop-1-ynyl)stannane?
The IUPAC name of tributyl(prop-1-ynyl)stannane (CID 2733165) is tributyl(prop-1-ynyl)stannane.
What is the SMILES notation for tributyl(prop-1-ynyl)stannane?
The canonical SMILES for tributyl(prop-1-ynyl)stannane is CC#C[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(prop-1-ynyl)stannane?
The InChIKey is KCQJLTOSSVXOCC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H9.C3H3.Sn/c3*1-3-4-2;1-3-2;/h3*1,3-4H2,2H3;1H3;.
What are the key properties of tributyl(prop-1-ynyl)stannane?
tributyl(prop-1-ynyl)stannane has a molecular weight of 329.12 g/mol, XLogP of 5.40, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(prop-1-ynyl)stannane is sourced from PubChem (CID 2733165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).