trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane

C26H54O2SiSn — CID 164686396

IUPACtrimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\[Si](C)(C)C)CCCCOC1CCCCO1
InChIInChI=1S/C14H27O2Si.3C4H9.Sn/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14;3*1-3-4-2;/h13-14H,4-8,10-12H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyFIJNALJLMFHUQR-UHFFFAOYSA-N
MW545.51 g/mol
LogP8.89
Rot. Bonds17

About trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane

trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane (PubChem CID 164686396) has the molecular formula C26H54O2SiSn and a molecular weight of 545.51 g/mol. Its IUPAC name is trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane
PubChem CID164686396
Molecular FormulaC26H54O2SiSn
Molecular Weight545.51 g/mol
Exact Mass546.29
IUPAC Nametrimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\[Si](C)(C)C)CCCCOC1CCCCO1
InChIInChI=1S/C14H27O2Si.3C4H9.Sn/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14;3*1-3-4-2;/h13-14H,4-8,10-12H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyFIJNALJLMFHUQR-UHFFFAOYSA-N
XLogP8.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500545.51
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tributyl-[(E)-5-(oxan-2-yloxy)pent-1-enyl]stannane
CID 10095712
Dimethyl-[5-(oxan-2-yloxy)penta-1,3-diynyl]-pent-4-enoxysilane
CID 134885323
tributyl-[(E)-2-methyl-5-(oxan-2-yloxy)pent-1-enyl]stannane
CID 134887422
CID 134901533
CID 134901533
CID 134901564
CID 134901564
CID 134901565
CID 134901565
CID 134901566
CID 134901566
trimethyl-[(Z)-4-(oxan-2-yloxy)-2-tributylstannylbut-1-enyl]silane
CID 134901603
[2-Ethenylidene-5-(oxan-2-yloxy)pentyl]-trimethylsilane
CID 139254383
trimethyl-[(Z)-7-(oxan-2-yloxy)hept-2-en-3-yl]silane
CID 5386733
Tetrahydro-2H-pyran-2-yl 5-(trimethylsilyl)-5-heptenyl ether
CID 5778794
tributyl-[(Z)-5-(oxan-2-yloxy)pent-1-enyl]stannane
CID 10671602

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane?
The IUPAC name of trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane (CID 164686396) is trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane.
What is the SMILES notation for trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane?
The canonical SMILES for trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane is CCCC[Sn](CCCC)(CCCC)/C(=C\[Si](C)(C)C)CCCCOC1CCCCO1.
What is the InChIKey of trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane?
The InChIKey is FIJNALJLMFHUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27O2Si.3C4H9.Sn/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14;3*1-3-4-2;/h13-14H,4-8,10-12H2,1-3H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane?
trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane has a molecular weight of 545.51 g/mol, XLogP of 8.89, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-6-(oxan-2-yloxy)-2-tributylstannylhex-1-enyl]silane is sourced from PubChem (CID 164686396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).