diethoxy-methyl-[(E)-2-phenylethenyl]silane

C13H20O2Si — CID 11806649

IUPACdiethoxy-methyl-[(E)-2-phenylethenyl]silane
SMILESCCO[Si](C)(/C=C/c1ccccc1)OCC
InChIInChI=1S/C13H20O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3/b12-11+
InChIKeyXZIACLDDGAVGLC-VAWYXSNFSA-N
MW236.39 g/mol
LogP3.38
Rot. Bonds6

About diethoxy-methyl-[(E)-2-phenylethenyl]silane

diethoxy-methyl-[(E)-2-phenylethenyl]silane (PubChem CID 11806649) has the molecular formula C13H20O2Si and a molecular weight of 236.39 g/mol. Its IUPAC name is diethoxy-methyl-[(E)-2-phenylethenyl]silane.

Molecular Properties

Compound Namediethoxy-methyl-[(E)-2-phenylethenyl]silane
PubChem CID11806649
Molecular FormulaC13H20O2Si
Molecular Weight236.39 g/mol
Exact Mass236.12
IUPAC Namediethoxy-methyl-[(E)-2-phenylethenyl]silane
SMILESCCO[Si](C)(/C=C/c1ccccc1)OCC
InChIInChI=1S/C13H20O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3/b12-11+
InChIKeyXZIACLDDGAVGLC-VAWYXSNFSA-N
XLogP3.38
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.39
LogP ≤ 53.38
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 diethoxy-methyl-[(E)-2-phenylethenyl]silane?
The IUPAC name of diethoxy-methyl-[(E)-2-phenylethenyl]silane (CID 11806649) is diethoxy-methyl-[(E)-2-phenylethenyl]silane.
What is the SMILES notation for diethoxy-methyl-[(E)-2-phenylethenyl]silane?
The canonical SMILES for diethoxy-methyl-[(E)-2-phenylethenyl]silane is CCO[Si](C)(/C=C/c1ccccc1)OCC.
What is the InChIKey of diethoxy-methyl-[(E)-2-phenylethenyl]silane?
The InChIKey is XZIACLDDGAVGLC-VAWYXSNFSA-N. The full InChI is InChI=1S/C13H20O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3/b12-11+.
What are the key properties of diethoxy-methyl-[(E)-2-phenylethenyl]silane?
diethoxy-methyl-[(E)-2-phenylethenyl]silane has a molecular weight of 236.39 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-[(E)-2-phenylethenyl]silane is sourced from PubChem (CID 11806649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).