CID 173361207

H9AlBCaO4Si — CID 173361207

About CID 173361207

CID 173361207 (PubChem CID 173361207) has the molecular formula H9AlBCaO4Si and a molecular weight of 179.03 g/mol.

Molecular Properties

• Compound Name: CID 173361207
• PubChem CID: 173361207
• Molecular Formula: H9AlBCaO4Si
• Molecular Weight: 179.03 g/mol
• Exact Mass: 178.98
• IUPAC Name: —
• SMILES: O[Si](O)(O)O.[AlH3].[B].[Ca+2].[H-].[H-]
• InChI: InChI=1S/Al.B.Ca.H4O4Si.5H/c;;;1-5(2,3)4;;;;;/h;;;1-4H;;;;;/q;;+2;;;;;2*-1
• InChIKey: FVOQIGGKLGYZEP-UHFFFAOYSA-N
• XLogP: -4.33
• TPSA: 80.92 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 4
• Heavy Atoms: 8
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	179.03
LogP ≤ 5	-4.33
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of CID 173361207?

The IUPAC name of CID 173361207 (CID 173361207) is not available.

What is the SMILES notation for CID 173361207?

The canonical SMILES for CID 173361207 is O[Si](O)(O)O.[AlH3].[B].[Ca+2].[H-].[H-].

What is the InChIKey of CID 173361207?

The InChIKey is FVOQIGGKLGYZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.B.Ca.H4O4Si.5H/c;;;1-5(2,3)4;;;;;/h;;;1-4H;;;;;/q;;+2;;;;;2*-1.

What are the key properties of CID 173361207?

CID 173361207 has a molecular weight of 179.03 g/mol, XLogP of -4.33, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for CID 173361207 is sourced from PubChem (CID 173361207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).