3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane

C12H22O2Si — CID 173227910

IUPAC3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane
SMILESC=CCOC(C=C[Si](C)(C)C)OCC=C
InChIInChI=1S/C12H22O2Si/c1-6-9-13-12(14-10-7-2)8-11-15(3,4)5/h6-8,11-12H,1-2,9-10H2,3-5H3
InChIKeyCWXJEXRRAHMYLR-UHFFFAOYSA-N
MW226.39 g/mol
LogP3.15
Rot. Bonds8

About 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane

3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane (PubChem CID 173227910) has the molecular formula C12H22O2Si and a molecular weight of 226.39 g/mol. Its IUPAC name is 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane.

Molecular Properties

Compound Name3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane
PubChem CID173227910
Molecular FormulaC12H22O2Si
Molecular Weight226.39 g/mol
Exact Mass226.14
IUPAC Name3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane
SMILESC=CCOC(C=C[Si](C)(C)C)OCC=C
InChIInChI=1S/C12H22O2Si/c1-6-9-13-12(14-10-7-2)8-11-15(3,4)5/h6-8,11-12H,1-2,9-10H2,3-5H3
InChIKeyCWXJEXRRAHMYLR-UHFFFAOYSA-N
XLogP3.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.39
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane?
The IUPAC name of 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane (CID 173227910) is 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane.
What is the SMILES notation for 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane?
The canonical SMILES for 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane is C=CCOC(C=C[Si](C)(C)C)OCC=C.
What is the InChIKey of 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane?
The InChIKey is CWXJEXRRAHMYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2Si/c1-6-9-13-12(14-10-7-2)8-11-15(3,4)5/h6-8,11-12H,1-2,9-10H2,3-5H3.
What are the key properties of 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane?
3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane has a molecular weight of 226.39 g/mol, XLogP of 3.15, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(prop-2-enoxy)prop-1-enyl-trimethylsilane is sourced from PubChem (CID 173227910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).