(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane

C19H40Si2Sn — CID 10575231

IUPAC(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane
SMILESCCCC[Sn]1(CCCC)C=CC([Si](C)(C)C)C=C1[Si](C)(C)C
InChIInChI=1S/C11H22Si2.2C4H9.Sn/c1-8-11(13(5,6)7)9-10-12(2,3)4;2*1-3-4-2;/h1,8-9,11H,2-7H3;2*1,3-4H2,2H3;
InChIKeyJQVXCHBXXUOQOQ-UHFFFAOYSA-N
MW443.41 g/mol
LogP7.20
Rot. Bonds8

About (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane

(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane (PubChem CID 10575231) has the molecular formula C19H40Si2Sn and a molecular weight of 443.41 g/mol. Its IUPAC name is (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane.

Molecular Properties

Compound Name(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane
PubChem CID10575231
Molecular FormulaC19H40Si2Sn
Molecular Weight443.41 g/mol
Exact Mass444.17
IUPAC Name(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane
SMILESCCCC[Sn]1(CCCC)C=CC([Si](C)(C)C)C=C1[Si](C)(C)C
InChIInChI=1S/C11H22Si2.2C4H9.Sn/c1-8-11(13(5,6)7)9-10-12(2,3)4;2*1-3-4-2;/h1,8-9,11H,2-7H3;2*1,3-4H2,2H3;
InChIKeyJQVXCHBXXUOQOQ-UHFFFAOYSA-N
XLogP7.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.41
LogP ≤ 57.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane?
The IUPAC name of (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane (CID 10575231) is (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane.
What is the SMILES notation for (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane?
The canonical SMILES for (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane is CCCC[Sn]1(CCCC)C=CC([Si](C)(C)C)C=C1[Si](C)(C)C.
What is the InChIKey of (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane?
The InChIKey is JQVXCHBXXUOQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Si2.2C4H9.Sn/c1-8-11(13(5,6)7)9-10-12(2,3)4;2*1-3-4-2;/h1,8-9,11H,2-7H3;2*1,3-4H2,2H3;.
What are the key properties of (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane?
(1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane has a molecular weight of 443.41 g/mol, XLogP of 7.20, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-dibutyl-2-trimethylsilyl-4H-stannin-4-yl)-trimethylsilane is sourced from PubChem (CID 10575231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).