Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane

C₇H₃Cl₂F₅Si — CID 154057853

About Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane

Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane (PubChem CID 154057853) has the molecular formula C₇H₃Cl₂F₅Si and a molecular weight of 281.08 g/mol. Its IUPAC name is dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane.

Molecular Properties

• Compound Name: Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane
• PubChem CID: 154057853
• Molecular Formula: C₇H₃Cl₂F₅Si
• Molecular Weight: 281.08 g/mol
• Exact Mass: 279.93
• IUPAC Name: dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane
• SMILES: Fc1c(F)c(F)c(C[SiH](Cl)Cl)c(F)c1F
• InChI: InChI=1S/C7H3Cl2F5Si/c8-15(9)1-2-3(10)5(12)7(14)6(13)4(2)11/h15H,1H2
• InChIKey: RZQBUHLRWHBVCL-UHFFFAOYSA-N
• XLogP: 3.16
• TPSA: 0.00 Ų
• Rotatable Bonds: 2
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	281.08
LogP ≤ 5	3.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane?

The IUPAC name of Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane (CID 154057853) is dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane.

What is the SMILES notation for Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane?

The canonical SMILES for Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane is Fc1c(F)c(F)c(C[SiH](Cl)Cl)c(F)c1F.

What is the InChIKey of Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane?

The InChIKey is RZQBUHLRWHBVCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3Cl2F5Si/c8-15(9)1-2-3(10)5(12)7(14)6(13)4(2)11/h15H,1H2.

What are the key properties of Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane?

Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane has a molecular weight of 281.08 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for Dichloro-[(2,3,4,5,6-pentafluorophenyl)methyl]silane is sourced from PubChem (CID 154057853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 154057853 — identifiers, structure, computed properties (public domain)

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