CID 172721003

C₈H₁₄Cl₂CrSi — CID 172721003

About CID 172721003

CID 172721003 (PubChem CID 172721003) has the molecular formula C₈H₁₄Cl₂CrSi and a molecular weight of 261.19 g/mol.

Molecular Properties

• Compound Name: CID 172721003
• PubChem CID: 172721003
• Molecular Formula: C₈H₁₄Cl₂CrSi
• Molecular Weight: 261.19 g/mol
• Exact Mass: 259.96
• IUPAC Name: —
• SMILES: C[Si](C)C.[Cl-].[Cl-].[Cr+3].c1cc[cH-]c1
• InChI: InChI=1S/C5H5.C3H9Si.2ClH.Cr/c1-2-4-5-3-1;1-4(2)3;;;/h1-5H;1-3H3;2*1H;/q-1;;;;+3/p-2
• InChIKey: GIBIKVLKQUDSPJ-UHFFFAOYSA-L
• XLogP: -3.22
• TPSA: 0.00 Ų
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	261.19
LogP ≤ 5	-3.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of CID 172721003?

The IUPAC name of CID 172721003 (CID 172721003) is not available.

What is the SMILES notation for CID 172721003?

The canonical SMILES for CID 172721003 is C[Si](C)C.[Cl-].[Cl-].[Cr+3].c1cc[cH-]c1.

What is the InChIKey of CID 172721003?

The InChIKey is GIBIKVLKQUDSPJ-UHFFFAOYSA-L. The full InChI is InChI=1S/C5H5.C3H9Si.2ClH.Cr/c1-2-4-5-3-1;1-4(2)3;;;/h1-5H;1-3H3;2*1H;/q-1;;;;+3/p-2.

What are the key properties of CID 172721003?

CID 172721003 has a molecular weight of 261.19 g/mol, XLogP of -3.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for CID 172721003 is sourced from PubChem (CID 172721003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 172721003 — identifiers, structure, computed properties (public domain)

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