ethenyl-methyl-bis(3-methylbutoxy)silane

C13H28O2Si — CID 91736447

IUPACethenyl-methyl-bis(3-methylbutoxy)silane
SMILESC=C[Si](C)(OCCC(C)C)OCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-7-16(6,14-10-8-12(2)3)15-11-9-13(4)5/h7,12-13H,1,8-11H2,2-6H3
InChIKeyUQEZQGILPXQRTN-UHFFFAOYSA-N
MW244.45 g/mol
LogP3.91
Rot. Bonds9

About ethenyl-methyl-bis(3-methylbutoxy)silane

ethenyl-methyl-bis(3-methylbutoxy)silane (PubChem CID 91736447) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is ethenyl-methyl-bis(3-methylbutoxy)silane.

Molecular Properties

Compound Nameethenyl-methyl-bis(3-methylbutoxy)silane
PubChem CID91736447
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nameethenyl-methyl-bis(3-methylbutoxy)silane
SMILESC=C[Si](C)(OCCC(C)C)OCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-7-16(6,14-10-8-12(2)3)15-11-9-13(4)5/h7,12-13H,1,8-11H2,2-6H3
InChIKeyUQEZQGILPXQRTN-UHFFFAOYSA-N
XLogP3.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethenyl-methyl-bis(3-methylbutoxy)silane?
The IUPAC name of ethenyl-methyl-bis(3-methylbutoxy)silane (CID 91736447) is ethenyl-methyl-bis(3-methylbutoxy)silane.
What is the SMILES notation for ethenyl-methyl-bis(3-methylbutoxy)silane?
The canonical SMILES for ethenyl-methyl-bis(3-methylbutoxy)silane is C=C[Si](C)(OCCC(C)C)OCCC(C)C.
What is the InChIKey of ethenyl-methyl-bis(3-methylbutoxy)silane?
The InChIKey is UQEZQGILPXQRTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-7-16(6,14-10-8-12(2)3)15-11-9-13(4)5/h7,12-13H,1,8-11H2,2-6H3.
What are the key properties of ethenyl-methyl-bis(3-methylbutoxy)silane?
ethenyl-methyl-bis(3-methylbutoxy)silane has a molecular weight of 244.45 g/mol, XLogP of 3.91, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-bis(3-methylbutoxy)silane is sourced from PubChem (CID 91736447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).