bis(3-methylbut-3-enoxy)-diphenylsilane

C22H28O2Si — CID 91739871

IUPACbis(3-methylbut-3-enoxy)-diphenylsilane
SMILESC=C(C)CCO[Si](OCCC(=C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28O2Si/c1-19(2)15-17-23-25(24-18-16-20(3)4,21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14H,1,3,15-18H2,2,4H3
InChIKeyNIONPLPCHSAOER-UHFFFAOYSA-N
MW352.55 g/mol
LogP4.21
Rot. Bonds10

About bis(3-methylbut-3-enoxy)-diphenylsilane

bis(3-methylbut-3-enoxy)-diphenylsilane (PubChem CID 91739871) has the molecular formula C22H28O2Si and a molecular weight of 352.55 g/mol. Its IUPAC name is bis(3-methylbut-3-enoxy)-diphenylsilane.

Molecular Properties

Compound Namebis(3-methylbut-3-enoxy)-diphenylsilane
PubChem CID91739871
Molecular FormulaC22H28O2Si
Molecular Weight352.55 g/mol
Exact Mass352.19
IUPAC Namebis(3-methylbut-3-enoxy)-diphenylsilane
SMILESC=C(C)CCO[Si](OCCC(=C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28O2Si/c1-19(2)15-17-23-25(24-18-16-20(3)4,21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14H,1,3,15-18H2,2,4H3
InChIKeyNIONPLPCHSAOER-UHFFFAOYSA-N
XLogP4.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.55
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Diphenyldimethoxysilane
CID 81284
Phenyltriethoxysilane
CID 13075
Ethoxydimethylphenylsilane
CID 15770
Diphenyldiethoxysilane
CID 75705
Benzene, (diethoxymethylsilyl)-
CID 69891
Benzene, 1,1',1''-(ethoxysilylidyne)tris-
CID 73695
Ethoxymethyldiphenylsilane
CID 74576
Methoxytriphenylsilane
CID 74588
Silane, (1,1-dimethylethyl)diphenyl(2-propynyloxy)-
CID 610226
Diphenylvinylethoxysilane
CID 87366
Trisiloxane, 1,5-diethenyl-1,1,5,5-tetramethyl-3,3-diphenyl-
CID 87707
Diphenyl[2-(triethoxysilyl)ethyl]phosphine
CID 87708

Frequently Asked Questions

What is the IUPAC name of bis(3-methylbut-3-enoxy)-diphenylsilane?
The IUPAC name of bis(3-methylbut-3-enoxy)-diphenylsilane (CID 91739871) is bis(3-methylbut-3-enoxy)-diphenylsilane.
What is the SMILES notation for bis(3-methylbut-3-enoxy)-diphenylsilane?
The canonical SMILES for bis(3-methylbut-3-enoxy)-diphenylsilane is C=C(C)CCO[Si](OCCC(=C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of bis(3-methylbut-3-enoxy)-diphenylsilane?
The InChIKey is NIONPLPCHSAOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28O2Si/c1-19(2)15-17-23-25(24-18-16-20(3)4,21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14H,1,3,15-18H2,2,4H3.
What are the key properties of bis(3-methylbut-3-enoxy)-diphenylsilane?
bis(3-methylbut-3-enoxy)-diphenylsilane has a molecular weight of 352.55 g/mol, XLogP of 4.21, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-methylbut-3-enoxy)-diphenylsilane is sourced from PubChem (CID 91739871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).