CID 22975848

C5H13OSi — CID 22975848

IUPAC—
SMILESCOCC[Si](C)C
InChIInChI=1S/C5H13OSi/c1-6-4-5-7(2)3/h4-5H2,1-3H3
InChIKeyZUPKDXLYGWELDN-UHFFFAOYSA-N
MW117.24 g/mol
LogP1.39
Rot. Bonds3

About CID 22975848

CID 22975848 (PubChem CID 22975848) has the molecular formula C5H13OSi and a molecular weight of 117.24 g/mol.

Molecular Properties

Compound NameCID 22975848
PubChem CID22975848
Molecular FormulaC5H13OSi
Molecular Weight117.24 g/mol
Exact Mass117.07
IUPAC Name—
SMILESCOCC[Si](C)C
InChIInChI=1S/C5H13OSi/c1-6-4-5-7(2)3/h4-5H2,1-3H3
InChIKeyZUPKDXLYGWELDN-UHFFFAOYSA-N
XLogP1.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.24
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 CID 22975848?
The IUPAC name of CID 22975848 (CID 22975848) is not available.
What is the SMILES notation for CID 22975848?
The canonical SMILES for CID 22975848 is COCC[Si](C)C.
What is the InChIKey of CID 22975848?
The InChIKey is ZUPKDXLYGWELDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13OSi/c1-6-4-5-7(2)3/h4-5H2,1-3H3.
What are the key properties of CID 22975848?
CID 22975848 has a molecular weight of 117.24 g/mol, XLogP of 1.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22975848 is sourced from PubChem (CID 22975848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).