tributyl(2-tert-butylstannylpropan-2-yloxy)silane

C19H44OSiSn — CID 174408543

IUPACtributyl(2-tert-butylstannylpropan-2-yloxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OC(C)(C)[SnH2]C(C)(C)C
InChIInChI=1S/C15H33OSi.C4H9.Sn.2H/c1-6-9-12-17(13-10-7-2,14-11-8-3)16-15(4)5;1-4(2)3;;;/h6-14H2,1-5H3;1-3H3;;;
InChIKeyPKFFVCXLHWKFMH-UHFFFAOYSA-N
MW435.36 g/mol
LogP6.47
Rot. Bonds12

About tributyl(2-tert-butylstannylpropan-2-yloxy)silane

tributyl(2-tert-butylstannylpropan-2-yloxy)silane (PubChem CID 174408543) has the molecular formula C19H44OSiSn and a molecular weight of 435.36 g/mol. Its IUPAC name is tributyl(2-tert-butylstannylpropan-2-yloxy)silane.

Molecular Properties

Compound Nametributyl(2-tert-butylstannylpropan-2-yloxy)silane
PubChem CID174408543
Molecular FormulaC19H44OSiSn
Molecular Weight435.36 g/mol
Exact Mass436.22
IUPAC Nametributyl(2-tert-butylstannylpropan-2-yloxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OC(C)(C)[SnH2]C(C)(C)C
InChIInChI=1S/C15H33OSi.C4H9.Sn.2H/c1-6-9-12-17(13-10-7-2,14-11-8-3)16-15(4)5;1-4(2)3;;;/h6-14H2,1-5H3;1-3H3;;;
InChIKeyPKFFVCXLHWKFMH-UHFFFAOYSA-N
XLogP6.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.36
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tributyl(2-tert-butylstannylpropan-2-yloxy)silane?
The IUPAC name of tributyl(2-tert-butylstannylpropan-2-yloxy)silane (CID 174408543) is tributyl(2-tert-butylstannylpropan-2-yloxy)silane.
What is the SMILES notation for tributyl(2-tert-butylstannylpropan-2-yloxy)silane?
The canonical SMILES for tributyl(2-tert-butylstannylpropan-2-yloxy)silane is CCCC[Si](CCCC)(CCCC)OC(C)(C)[SnH2]C(C)(C)C.
What is the InChIKey of tributyl(2-tert-butylstannylpropan-2-yloxy)silane?
The InChIKey is PKFFVCXLHWKFMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33OSi.C4H9.Sn.2H/c1-6-9-12-17(13-10-7-2,14-11-8-3)16-15(4)5;1-4(2)3;;;/h6-14H2,1-5H3;1-3H3;;;.
What are the key properties of tributyl(2-tert-butylstannylpropan-2-yloxy)silane?
tributyl(2-tert-butylstannylpropan-2-yloxy)silane has a molecular weight of 435.36 g/mol, XLogP of 6.47, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(2-tert-butylstannylpropan-2-yloxy)silane is sourced from PubChem (CID 174408543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).