CID 22228898

C11H21Si — CID 22228898

IUPAC—
SMILESC=CC([Si])(CC(C)C)CC(C)C
InChIInChI=1S/C11H21Si/c1-6-11(12,7-9(2)3)8-10(4)5/h6,9-10H,1,7-8H2,2-5H3
InChIKeyVPIWNRKJCGEVKD-UHFFFAOYSA-N
MW181.37 g/mol
LogP3.59
Rot. Bonds5

About CID 22228898

CID 22228898 (PubChem CID 22228898) has the molecular formula C11H21Si and a molecular weight of 181.37 g/mol.

Molecular Properties

Compound NameCID 22228898
PubChem CID22228898
Molecular FormulaC11H21Si
Molecular Weight181.37 g/mol
Exact Mass181.14
IUPAC Name—
SMILESC=CC([Si])(CC(C)C)CC(C)C
InChIInChI=1S/C11H21Si/c1-6-11(12,7-9(2)3)8-10(4)5/h6,9-10H,1,7-8H2,2-5H3
InChIKeyVPIWNRKJCGEVKD-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.37
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 CID 22228898?
The IUPAC name of CID 22228898 (CID 22228898) is not available.
What is the SMILES notation for CID 22228898?
The canonical SMILES for CID 22228898 is C=CC([Si])(CC(C)C)CC(C)C.
What is the InChIKey of CID 22228898?
The InChIKey is VPIWNRKJCGEVKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21Si/c1-6-11(12,7-9(2)3)8-10(4)5/h6,9-10H,1,7-8H2,2-5H3.
What are the key properties of CID 22228898?
CID 22228898 has a molecular weight of 181.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22228898 is sourced from PubChem (CID 22228898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).