2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane

C10H18O2Si — CID 170995189

IUPAC2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane
SMILESCO[Si](C)(CCC1C=CC=C1)OC
InChIInChI=1S/C10H18O2Si/c1-11-13(3,12-2)9-8-10-6-4-5-7-10/h4-7,10H,8-9H2,1-3H3
InChIKeyIFWOMAZBWOSEJM-UHFFFAOYSA-N
MW198.34 g/mol
LogP2.48
Rot. Bonds5

About 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane

2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane (PubChem CID 170995189) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane.

Molecular Properties

Compound Name2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane
PubChem CID170995189
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Name2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane
SMILESCO[Si](C)(CCC1C=CC=C1)OC
InChIInChI=1S/C10H18O2Si/c1-11-13(3,12-2)9-8-10-6-4-5-7-10/h4-7,10H,8-9H2,1-3H3
InChIKeyIFWOMAZBWOSEJM-UHFFFAOYSA-N
XLogP2.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.34
LogP ≤ 52.48
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 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane?
The IUPAC name of 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane (CID 170995189) is 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane.
What is the SMILES notation for 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane?
The canonical SMILES for 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane is CO[Si](C)(CCC1C=CC=C1)OC.
What is the InChIKey of 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane?
The InChIKey is IFWOMAZBWOSEJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2Si/c1-11-13(3,12-2)9-8-10-6-4-5-7-10/h4-7,10H,8-9H2,1-3H3.
What are the key properties of 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane?
2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane has a molecular weight of 198.34 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopenta-2,4-dien-1-ylethyl-dimethoxy-methylsilane is sourced from PubChem (CID 170995189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).