[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane

C11H20OSi — CID 173207930

IUPAC[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane
SMILESCCCOC(C1=CCC=C1)[SiH](C)C
InChIInChI=1S/C11H20OSi/c1-4-9-12-11(13(2)3)10-7-5-6-8-10/h5,7-8,11,13H,4,6,9H2,1-3H3
InChIKeyXLYOTQGAJDCYOM-UHFFFAOYSA-N
MW196.37 g/mol
LogP2.69
Rot. Bonds5

About [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane

[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane (PubChem CID 173207930) has the molecular formula C11H20OSi and a molecular weight of 196.37 g/mol. Its IUPAC name is [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane.

Molecular Properties

Compound Name[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane
PubChem CID173207930
Molecular FormulaC11H20OSi
Molecular Weight196.37 g/mol
Exact Mass196.13
IUPAC Name[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane
SMILESCCCOC(C1=CCC=C1)[SiH](C)C
InChIInChI=1S/C11H20OSi/c1-4-9-12-11(13(2)3)10-7-5-6-8-10/h5,7-8,11,13H,4,6,9H2,1-3H3
InChIKeyXLYOTQGAJDCYOM-UHFFFAOYSA-N
XLogP2.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.37
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(3E)-3-(4-methylideneoxolan-3-ylidene)prop-1-en-2-yl]oxysilane
CID 134863591
[2-(1-Methoxyethyl)cyclopenta-1,3-dien-1-yl]-trimethylsilane
CID 18766820
(1-Butoxy-2-methylcyclohexa-2,4-dien-1-yl)-cyclopenta-1,3-dien-1-yl-dimethylsilane
CID 70017508
Trimethyl-(1-propoxycyclopenta-2,4-dien-1-yl)silane
CID 140045016
[2-(Methoxymethyl)cyclopenta-1,4-dien-1-yl]-trimethylsilane
CID 141806268
3-[(1Z)-buta-1,3-dienyl]-4-methyl-2,5-dihydrofuran;ethane
CID 145583197
[Cyclopenta-1,4-dien-1-yl(propan-2-yloxy)methyl]-dimethylsilane;titanium(3+);dichloride
CID 173207920
(2-Cyclopenta-1,4-dien-1-yl-2-propoxyethyl)-dimethylsilane;titanium(3+);dichloride
CID 173207924
[Cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane;titanium(3+);dichloride
CID 173207929
[Cyclopenta-1,4-dien-1-yl(methoxy)methyl]-dimethylsilane;titanium(3+);dichloride
CID 173207975
[Cyclopenta-1,4-dien-1-yl-[(2-methylpropan-2-yl)oxy]methyl]-dimethylsilane;titanium(3+);dichloride
CID 173207977
[Butoxy(cyclopenta-1,4-dien-1-yl)methyl]-dimethylsilane;titanium(3+);dichloride
CID 173208037

Frequently Asked Questions

What is the IUPAC name of [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane?
The IUPAC name of [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane (CID 173207930) is [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane.
What is the SMILES notation for [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane?
The canonical SMILES for [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane is CCCOC(C1=CCC=C1)[SiH](C)C.
What is the InChIKey of [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane?
The InChIKey is XLYOTQGAJDCYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20OSi/c1-4-9-12-11(13(2)3)10-7-5-6-8-10/h5,7-8,11,13H,4,6,9H2,1-3H3.
What are the key properties of [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane?
[cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane has a molecular weight of 196.37 g/mol, XLogP of 2.69, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclopenta-1,4-dien-1-yl(propoxy)methyl]-dimethylsilane is sourced from PubChem (CID 173207930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).