CID 23321698

C24H24O2Si — CID 23321698

IUPAC—
SMILESCCOC#CC1([Si]C(c2ccccc2)c2ccccc2)C=CC=CC1CO
InChIInChI=1S/C24H24O2Si/c1-2-26-18-17-24(16-10-9-15-22(24)19-25)27-23(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-16,22-23,25H,2,19H2,1H3
InChIKeyLHPROFSRTKEKAY-UHFFFAOYSA-N
MW372.54 g/mol
LogP4.37
Rot. Bonds6

About CID 23321698

CID 23321698 (PubChem CID 23321698) has the molecular formula C24H24O2Si and a molecular weight of 372.54 g/mol.

Molecular Properties

Compound NameCID 23321698
PubChem CID23321698
Molecular FormulaC24H24O2Si
Molecular Weight372.54 g/mol
Exact Mass372.15
IUPAC Name—
SMILESCCOC#CC1([Si]C(c2ccccc2)c2ccccc2)C=CC=CC1CO
InChIInChI=1S/C24H24O2Si/c1-2-26-18-17-24(16-10-9-15-22(24)19-25)27-23(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-16,22-23,25H,2,19H2,1H3
InChIKeyLHPROFSRTKEKAY-UHFFFAOYSA-N
XLogP4.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.54
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 23321698?
The IUPAC name of CID 23321698 (CID 23321698) is not available.
What is the SMILES notation for CID 23321698?
The canonical SMILES for CID 23321698 is CCOC#CC1([Si]C(c2ccccc2)c2ccccc2)C=CC=CC1CO.
What is the InChIKey of CID 23321698?
The InChIKey is LHPROFSRTKEKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O2Si/c1-2-26-18-17-24(16-10-9-15-22(24)19-25)27-23(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-16,22-23,25H,2,19H2,1H3.
What are the key properties of CID 23321698?
CID 23321698 has a molecular weight of 372.54 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23321698 is sourced from PubChem (CID 23321698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).