tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane

C17H34OSn — CID 10937608

IUPACtributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)C1=CC(C)CO1
InChIInChI=1S/C5H7O.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2,5H,4H2,1H3;3*1,3-4H2,2H3;
InChIKeyBNZODVHBBVCZNP-UHFFFAOYSA-N
MW373.17 g/mol
LogP5.92
Rot. Bonds10

About tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane

tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane (PubChem CID 10937608) has the molecular formula C17H34OSn and a molecular weight of 373.17 g/mol. Its IUPAC name is tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane.

Molecular Properties

Compound Nametributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane
PubChem CID10937608
Molecular FormulaC17H34OSn
Molecular Weight373.17 g/mol
Exact Mass374.16
IUPAC Nametributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)C1=CC(C)CO1
InChIInChI=1S/C5H7O.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2,5H,4H2,1H3;3*1,3-4H2,2H3;
InChIKeyBNZODVHBBVCZNP-UHFFFAOYSA-N
XLogP5.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.17
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane?
The IUPAC name of tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane (CID 10937608) is tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane.
What is the SMILES notation for tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane?
The canonical SMILES for tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane is CCCC[Sn](CCCC)(CCCC)C1=CC(C)CO1.
What is the InChIKey of tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane?
The InChIKey is BNZODVHBBVCZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7O.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2,5H,4H2,1H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane?
tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane has a molecular weight of 373.17 g/mol, XLogP of 5.92, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(3-methyl-2,3-dihydrofuran-5-yl)stannane is sourced from PubChem (CID 10937608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).