CID 22339060

C24H25O2Si — CID 22339060

IUPAC
SMILESCC(C)(C)C(O[Si](c1ccccc1)c1ccccc1)c1ccccc1C=O
InChIInChI=1S/C24H25O2Si/c1-24(2,3)23(22-17-11-10-12-19(22)18-25)26-27(20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-18,23H,1-3H3
InChIKeyFHKAKAFYDOALFS-UHFFFAOYSA-N
MW373.55 g/mol
LogP4.41
Rot. Bonds6

About CID 22339060

CID 22339060 (PubChem CID 22339060) has the molecular formula C24H25O2Si and a molecular weight of 373.55 g/mol.

Molecular Properties

Compound NameCID 22339060
PubChem CID22339060
Molecular FormulaC24H25O2Si
Molecular Weight373.55 g/mol
Exact Mass373.16
IUPAC Name
SMILESCC(C)(C)C(O[Si](c1ccccc1)c1ccccc1)c1ccccc1C=O
InChIInChI=1S/C24H25O2Si/c1-24(2,3)23(22-17-11-10-12-19(22)18-25)26-27(20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-18,23H,1-3H3
InChIKeyFHKAKAFYDOALFS-UHFFFAOYSA-N
XLogP4.41
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.55
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 22339060?
The IUPAC name of CID 22339060 (CID 22339060) is not available.
What is the SMILES notation for CID 22339060?
The canonical SMILES for CID 22339060 is CC(C)(C)C(O[Si](c1ccccc1)c1ccccc1)c1ccccc1C=O.
What is the InChIKey of CID 22339060?
The InChIKey is FHKAKAFYDOALFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25O2Si/c1-24(2,3)23(22-17-11-10-12-19(22)18-25)26-27(20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-18,23H,1-3H3.
What are the key properties of CID 22339060?
CID 22339060 has a molecular weight of 373.55 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22339060 is sourced from PubChem (CID 22339060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).