prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane

C22H44O4Si2 — CID 173009353

IUPACprop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane
SMILESC=CC[Si](CC=CC[Si](CC=C)(OCCC)OCCC)(OCCC)OCCC
InChIInChI=1S/C22H44O4Si2/c1-7-15-23-27(19-11-5,24-16-8-2)21-13-14-22-28(20-12-6,25-17-9-3)26-18-10-4/h11-14H,5-10,15-22H2,1-4H3
InChIKeyMWWFZESNYCMORI-UHFFFAOYSA-N
MW428.76 g/mol
LogP6.51
Rot. Bonds20

About prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane

prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane (PubChem CID 173009353) has the molecular formula C22H44O4Si2 and a molecular weight of 428.76 g/mol. Its IUPAC name is prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane.

Molecular Properties

Compound Nameprop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane
PubChem CID173009353
Molecular FormulaC22H44O4Si2
Molecular Weight428.76 g/mol
Exact Mass428.28
IUPAC Nameprop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane
SMILESC=CC[Si](CC=CC[Si](CC=C)(OCCC)OCCC)(OCCC)OCCC
InChIInChI=1S/C22H44O4Si2/c1-7-15-23-27(19-11-5,24-16-8-2)21-13-14-22-28(20-12-6,25-17-9-3)26-18-10-4/h11-14H,5-10,15-22H2,1-4H3
InChIKeyMWWFZESNYCMORI-UHFFFAOYSA-N
XLogP6.51
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.76
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane?
The IUPAC name of prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane (CID 173009353) is prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane.
What is the SMILES notation for prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane?
The canonical SMILES for prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane is C=CC[Si](CC=CC[Si](CC=C)(OCCC)OCCC)(OCCC)OCCC.
What is the InChIKey of prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane?
The InChIKey is MWWFZESNYCMORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44O4Si2/c1-7-15-23-27(19-11-5,24-16-8-2)21-13-14-22-28(20-12-6,25-17-9-3)26-18-10-4/h11-14H,5-10,15-22H2,1-4H3.
What are the key properties of prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane?
prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane has a molecular weight of 428.76 g/mol, XLogP of 6.51, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl-[4-[prop-2-enyl(dipropoxy)silyl]but-2-enyl]-dipropoxysilane is sourced from PubChem (CID 173009353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).