CID 67414527

C20H18Si — CID 67414527

IUPAC—
SMILESCc1ccccc1[Si]C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18Si/c1-16-10-8-9-15-19(16)21-20(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-15,20H,1H3
InChIKeyWIMADLUPAVLSNP-UHFFFAOYSA-N
MW286.45 g/mol
LogP4.11
Rot. Bonds4

About CID 67414527

CID 67414527 (PubChem CID 67414527) has the molecular formula C20H18Si and a molecular weight of 286.45 g/mol.

Molecular Properties

Compound NameCID 67414527
PubChem CID67414527
Molecular FormulaC20H18Si
Molecular Weight286.45 g/mol
Exact Mass286.12
IUPAC Name—
SMILESCc1ccccc1[Si]C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18Si/c1-16-10-8-9-15-19(16)21-20(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-15,20H,1H3
InChIKeyWIMADLUPAVLSNP-UHFFFAOYSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.45
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 67414527?
The IUPAC name of CID 67414527 (CID 67414527) is not available.
What is the SMILES notation for CID 67414527?
The canonical SMILES for CID 67414527 is Cc1ccccc1[Si]C(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 67414527?
The InChIKey is WIMADLUPAVLSNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18Si/c1-16-10-8-9-15-19(16)21-20(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-15,20H,1H3.
What are the key properties of CID 67414527?
CID 67414527 has a molecular weight of 286.45 g/mol, XLogP of 4.11, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67414527 is sourced from PubChem (CID 67414527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).