CID 66688734

C9H12OSi — CID 66688734

IUPAC—
SMILESCO[Si]c1cccc(C)c1C
InChIInChI=1S/C9H12OSi/c1-7-5-4-6-9(8(7)2)11-10-3/h4-6H,1-3H3
InChIKeyXCHOXFDIQUJPDY-UHFFFAOYSA-N
MW164.28 g/mol
LogP1.19
Rot. Bonds2

About CID 66688734

CID 66688734 (PubChem CID 66688734) has the molecular formula C9H12OSi and a molecular weight of 164.28 g/mol.

Molecular Properties

Compound NameCID 66688734
PubChem CID66688734
Molecular FormulaC9H12OSi
Molecular Weight164.28 g/mol
Exact Mass164.07
IUPAC Name—
SMILESCO[Si]c1cccc(C)c1C
InChIInChI=1S/C9H12OSi/c1-7-5-4-6-9(8(7)2)11-10-3/h4-6H,1-3H3
InChIKeyXCHOXFDIQUJPDY-UHFFFAOYSA-N
XLogP1.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.28
LogP ≤ 51.19
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 66688734?
The IUPAC name of CID 66688734 (CID 66688734) is not available.
What is the SMILES notation for CID 66688734?
The canonical SMILES for CID 66688734 is CO[Si]c1cccc(C)c1C.
What is the InChIKey of CID 66688734?
The InChIKey is XCHOXFDIQUJPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12OSi/c1-7-5-4-6-9(8(7)2)11-10-3/h4-6H,1-3H3.
What are the key properties of CID 66688734?
CID 66688734 has a molecular weight of 164.28 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66688734 is sourced from PubChem (CID 66688734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).