CID 164810428

C9H7OSi — CID 164810428

IUPAC
SMILESO=[Si]C1C=Cc2ccccc21
InChIInChI=1S/C9H7OSi/c10-11-9-6-5-7-3-1-2-4-8(7)9/h1-6,9H
InChIKeyPJMFVVHWJRVAFC-UHFFFAOYSA-N
MW159.24 g/mol
LogP1.80
Rot. Bonds1

About CID 164810428

CID 164810428 (PubChem CID 164810428) has the molecular formula C9H7OSi and a molecular weight of 159.24 g/mol.

Molecular Properties

Compound NameCID 164810428
PubChem CID164810428
Molecular FormulaC9H7OSi
Molecular Weight159.24 g/mol
Exact Mass159.03
IUPAC Name
SMILESO=[Si]C1C=Cc2ccccc21
InChIInChI=1S/C9H7OSi/c10-11-9-6-5-7-3-1-2-4-8(7)9/h1-6,9H
InChIKeyPJMFVVHWJRVAFC-UHFFFAOYSA-N
XLogP1.80
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.24
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 164810428?
The IUPAC name of CID 164810428 (CID 164810428) is not available.
What is the SMILES notation for CID 164810428?
The canonical SMILES for CID 164810428 is O=[Si]C1C=Cc2ccccc21.
What is the InChIKey of CID 164810428?
The InChIKey is PJMFVVHWJRVAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7OSi/c10-11-9-6-5-7-3-1-2-4-8(7)9/h1-6,9H.
What are the key properties of CID 164810428?
CID 164810428 has a molecular weight of 159.24 g/mol, XLogP of 1.80, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164810428 is sourced from PubChem (CID 164810428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).