tributyl-(4-chloro-3-pyridinyl)stannane

C17H30ClNSn — CID 10811131

IUPACtributyl-(4-chloro-3-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cnccc1Cl
InChIInChI=1S/C5H3ClN.3C4H9.Sn/c6-5-1-3-7-4-2-5;3*1-3-4-2;/h1,3-4H;3*1,3-4H2,2H3;
InChIKeyZUDFMNMRJSTEJR-UHFFFAOYSA-N
MW402.60 g/mol
LogP5.79
Rot. Bonds10

About tributyl-(4-chloro-3-pyridinyl)stannane

tributyl-(4-chloro-3-pyridinyl)stannane (PubChem CID 10811131) has the molecular formula C17H30ClNSn and a molecular weight of 402.60 g/mol. Its IUPAC name is tributyl-(4-chloro-3-pyridinyl)stannane.

Molecular Properties

Compound Nametributyl-(4-chloro-3-pyridinyl)stannane
PubChem CID10811131
Molecular FormulaC17H30ClNSn
Molecular Weight402.60 g/mol
Exact Mass403.11
IUPAC Nametributyl-(4-chloro-3-pyridinyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cnccc1Cl
InChIInChI=1S/C5H3ClN.3C4H9.Sn/c6-5-1-3-7-4-2-5;3*1-3-4-2;/h1,3-4H;3*1,3-4H2,2H3;
InChIKeyZUDFMNMRJSTEJR-UHFFFAOYSA-N
XLogP5.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.60
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl-(4-chloro-3-pyridinyl)stannane?
The IUPAC name of tributyl-(4-chloro-3-pyridinyl)stannane (CID 10811131) is tributyl-(4-chloro-3-pyridinyl)stannane.
What is the SMILES notation for tributyl-(4-chloro-3-pyridinyl)stannane?
The canonical SMILES for tributyl-(4-chloro-3-pyridinyl)stannane is CCCC[Sn](CCCC)(CCCC)c1cnccc1Cl.
What is the InChIKey of tributyl-(4-chloro-3-pyridinyl)stannane?
The InChIKey is ZUDFMNMRJSTEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClN.3C4H9.Sn/c6-5-1-3-7-4-2-5;3*1-3-4-2;/h1,3-4H;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(4-chloro-3-pyridinyl)stannane?
tributyl-(4-chloro-3-pyridinyl)stannane has a molecular weight of 402.60 g/mol, XLogP of 5.79, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(4-chloro-3-pyridinyl)stannane is sourced from PubChem (CID 10811131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).