CID 88962406

C23H26ClSi2 — CID 88962406

IUPAC
SMILESCc1cccc([Si](c2cc(C)cc([Si](C)(C)C)c2)c2ccccc2Cl)c1
InChIInChI=1S/C23H26ClSi2/c1-17-9-8-10-19(13-17)25(23-12-7-6-11-22(23)24)20-14-18(2)15-21(16-20)26(3,4)5/h6-16H,1-5H3
InChIKeyJPVZSUOSYLLNHC-UHFFFAOYSA-N
MW394.09 g/mol
LogP4.02
Rot. Bonds4

About CID 88962406

CID 88962406 (PubChem CID 88962406) has the molecular formula C23H26ClSi2 and a molecular weight of 394.09 g/mol.

Molecular Properties

Compound NameCID 88962406
PubChem CID88962406
Molecular FormulaC23H26ClSi2
Molecular Weight394.09 g/mol
Exact Mass393.13
IUPAC Name
SMILESCc1cccc([Si](c2cc(C)cc([Si](C)(C)C)c2)c2ccccc2Cl)c1
InChIInChI=1S/C23H26ClSi2/c1-17-9-8-10-19(13-17)25(23-12-7-6-11-22(23)24)20-14-18(2)15-21(16-20)26(3,4)5/h6-16H,1-5H3
InChIKeyJPVZSUOSYLLNHC-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.09
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 88962406?
The IUPAC name of CID 88962406 (CID 88962406) is not available.
What is the SMILES notation for CID 88962406?
The canonical SMILES for CID 88962406 is Cc1cccc([Si](c2cc(C)cc([Si](C)(C)C)c2)c2ccccc2Cl)c1.
What is the InChIKey of CID 88962406?
The InChIKey is JPVZSUOSYLLNHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26ClSi2/c1-17-9-8-10-19(13-17)25(23-12-7-6-11-22(23)24)20-14-18(2)15-21(16-20)26(3,4)5/h6-16H,1-5H3.
What are the key properties of CID 88962406?
CID 88962406 has a molecular weight of 394.09 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88962406 is sourced from PubChem (CID 88962406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).