tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane

C13H24O2Si — CID 101365733

IUPACtert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane
SMILESC=C1COCC1/C=C/O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H24O2Si/c1-11-9-14-10-12(11)7-8-15-16(5,6)13(2,3)4/h7-8,12H,1,9-10H2,2-6H3/b8-7+
InChIKeyKVIBPTCSQZTBMR-BQYQJAHWSA-N
MW240.42 g/mol
LogP3.72
Rot. Bonds3

About tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane

tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane (PubChem CID 101365733) has the molecular formula C13H24O2Si and a molecular weight of 240.42 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane
PubChem CID101365733
Molecular FormulaC13H24O2Si
Molecular Weight240.42 g/mol
Exact Mass240.15
IUPAC Nametert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane
SMILESC=C1COCC1/C=C/O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H24O2Si/c1-11-9-14-10-12(11)7-8-15-16(5,6)13(2,3)4/h7-8,12H,1,9-10H2,2-6H3/b8-7+
InChIKeyKVIBPTCSQZTBMR-BQYQJAHWSA-N
XLogP3.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane
CID 10774350
trimethyl-[(E)-2-(4-methyloxolan-3-yl)ethenoxy]silane
CID 10655670
trimethyl-[(Z)-(4-methyloxolan-3-ylidene)methyl]silane
CID 14270837
[(Z)-(4-ethenyl-4-methyloxolan-3-ylidene)methyl]-trimethylsilane
CID 132544915

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane (CID 101365733) is tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane is C=C1COCC1/C=C/O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane?
The InChIKey is KVIBPTCSQZTBMR-BQYQJAHWSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-11-9-14-10-12(11)7-8-15-16(5,6)13(2,3)4/h7-8,12H,1,9-10H2,2-6H3/b8-7+.
What are the key properties of tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane?
tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane has a molecular weight of 240.42 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(E)-2-(4-methylideneoxolan-3-yl)ethenoxy]silane is sourced from PubChem (CID 101365733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).