CID 159997610

C₆HBF₇ — CID 159997610

About CID 159997610

CID 159997610 (PubChem CID 159997610) has the molecular formula C₆HBF₇ and a molecular weight of 216.87 g/mol.

Molecular Properties

• Compound Name: CID 159997610
• PubChem CID: 159997610
• Molecular Formula: C₆HBF₇
• Molecular Weight: 216.87 g/mol
• Exact Mass: 217.01
• IUPAC Name: —
• SMILES: F.Fc1c(F)c(F)c(F)c(F)c1F.[B]
• InChI: InChI=1S/C6F6.B.FH/c7-1-2(8)4(10)6(12)5(11)3(1)9;;/h;;1H
• InChIKey: AIXUMTYXRWSRTQ-UHFFFAOYSA-N
• XLogP: 2.29
• TPSA: 0.00 Ų
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	216.87
LogP ≤ 5	2.29
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'}

Frequently Asked Questions

What is the IUPAC name of CID 159997610?

The IUPAC name of CID 159997610 (CID 159997610) is not available.

What is the SMILES notation for CID 159997610?

The canonical SMILES for CID 159997610 is F.Fc1c(F)c(F)c(F)c(F)c1F.[B].

What is the InChIKey of CID 159997610?

The InChIKey is AIXUMTYXRWSRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F6.B.FH/c7-1-2(8)4(10)6(12)5(11)3(1)9;;/h;;1H.

What are the key properties of CID 159997610?

CID 159997610 has a molecular weight of 216.87 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for CID 159997610 is sourced from PubChem (CID 159997610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159997610 — identifiers, structure, computed properties (public domain)

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