butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane

C17H36O3Si2 — CID 91736540

IUPACbutoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane
SMILESC=C[Si](C)(OCCCC)O[Si](C)(C=C)OC(C)CCCCC
InChIInChI=1S/C17H36O3Si2/c1-8-12-14-15-17(5)19-22(7,11-4)20-21(6,10-3)18-16-13-9-2/h10-11,17H,3-4,8-9,12-16H2,1-2,5-7H3
InChIKeyJQHCLHRNLSGMFA-UHFFFAOYSA-N
MW344.64 g/mol
LogP5.40
Rot. Bonds14

About butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane

butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane (PubChem CID 91736540) has the molecular formula C17H36O3Si2 and a molecular weight of 344.64 g/mol. Its IUPAC name is butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane.

Molecular Properties

Compound Namebutoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane
PubChem CID91736540
Molecular FormulaC17H36O3Si2
Molecular Weight344.64 g/mol
Exact Mass344.22
IUPAC Namebutoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane
SMILESC=C[Si](C)(OCCCC)O[Si](C)(C=C)OC(C)CCCCC
InChIInChI=1S/C17H36O3Si2/c1-8-12-14-15-17(5)19-22(7,11-4)20-21(6,10-3)18-16-13-9-2/h10-11,17H,3-4,8-9,12-16H2,1-2,5-7H3
InChIKeyJQHCLHRNLSGMFA-UHFFFAOYSA-N
XLogP5.40
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.64
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

Silane, dimethyldi(2-heptyloxy)-
CID 85694061
Silane, methylvinyl(octyloxy)octyloxy-
CID 23105081
Silane, methylvinyl(dodecyloxy)dodecyloxy-
CID 87770809
Silane, methylvinyldi(hexyloxy)-
CID 91739110
Silane, dimethyl(dimethyl(2-hexyloxy)silyloxy)hexyloxy-
CID 54770327
Silane, methylvinyl(oct-4-yloxy)isopropoxy-
CID 91699097
1,3-bis[(1-Ethylpentyl)oxy]-1,1,3,3-tetramethyldisiloxane
CID 91720804
Silane, methylvinyl(oct-2-yloxy)ethoxy-
CID 91723234
Silane, methylvinyl(oct-2-yloxy)propoxy-
CID 91726228
Silane, methylvinyl(pent-2-yloxy)(methylvinyl(pent-2-yloxy)silyloxy)-
CID 91726489
Silane, methylvinyl(hept-4-yloxy)(methylvinyl(hept-4-yloxy)silyloxy)-
CID 91726528
Silane, methylvinyl(oct-4-yloxy)(methylvinyl(oct-4-yloxy)silyloxy)-
CID 91726540

Frequently Asked Questions

What is the IUPAC name of butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane?
The IUPAC name of butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane (CID 91736540) is butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane.
What is the SMILES notation for butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane?
The canonical SMILES for butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane is C=C[Si](C)(OCCCC)O[Si](C)(C=C)OC(C)CCCCC.
What is the InChIKey of butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane?
The InChIKey is JQHCLHRNLSGMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O3Si2/c1-8-12-14-15-17(5)19-22(7,11-4)20-21(6,10-3)18-16-13-9-2/h10-11,17H,3-4,8-9,12-16H2,1-2,5-7H3.
What are the key properties of butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane?
butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane has a molecular weight of 344.64 g/mol, XLogP of 5.40, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-ethenyl-(ethenyl-heptan-2-yloxy-methylsilyl)oxy-methylsilane is sourced from PubChem (CID 91736540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).