OQRGVCDWBBBEOA-UHFFFAOYSA-N

C₂₂H₃₁FO₂Si — CID 91717507

About OQRGVCDWBBBEOA-UHFFFAOYSA-N

OQRGVCDWBBBEOA-UHFFFAOYSA-N (PubChem CID 91717507) has the molecular formula C₂₂H₃₁FO₂Si and a molecular weight of 374.57 g/mol. Its IUPAC name is 2-fluoroethoxy-octoxy-diphenylsilane.

Molecular Properties

• Compound Name: OQRGVCDWBBBEOA-UHFFFAOYSA-N
• PubChem CID: 91717507
• Molecular Formula: C₂₂H₃₁FO₂Si
• Molecular Weight: 374.57 g/mol
• Exact Mass: 374.21
• IUPAC Name: 2-fluoroethoxy-octoxy-diphenylsilane
• SMILES: CCCCCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C22H31FO2Si/c1-2-3-4-5-6-13-19-24-26(25-20-18-23,21-14-9-7-10-15-21)22-16-11-8-12-17-22/h7-12,14-17H,2-6,13,18-20H2,1H3
• InChIKey: OQRGVCDWBBBEOA-UHFFFAOYSA-N
• XLogP: 4.61
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 13
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	374.57
LogP ≤ 5	4.61
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of OQRGVCDWBBBEOA-UHFFFAOYSA-N?

The IUPAC name of OQRGVCDWBBBEOA-UHFFFAOYSA-N (CID 91717507) is 2-fluoroethoxy-octoxy-diphenylsilane.

What is the SMILES notation for OQRGVCDWBBBEOA-UHFFFAOYSA-N?

The canonical SMILES for OQRGVCDWBBBEOA-UHFFFAOYSA-N is CCCCCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1.

What is the InChIKey of OQRGVCDWBBBEOA-UHFFFAOYSA-N?

The InChIKey is OQRGVCDWBBBEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31FO2Si/c1-2-3-4-5-6-13-19-24-26(25-20-18-23,21-14-9-7-10-15-21)22-16-11-8-12-17-22/h7-12,14-17H,2-6,13,18-20H2,1H3.

What are the key properties of OQRGVCDWBBBEOA-UHFFFAOYSA-N?

OQRGVCDWBBBEOA-UHFFFAOYSA-N has a molecular weight of 374.57 g/mol, XLogP of 4.61, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for OQRGVCDWBBBEOA-UHFFFAOYSA-N is sourced from PubChem (CID 91717507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 91717507 — identifiers, structure, computed properties (public domain)

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