CID 23434735

C22H20OSi — CID 23434735

IUPAC—
SMILESCC(C)(C)O[Si]c1cccc2cc3cc4ccccc4cc3cc12
InChIInChI=1S/C22H20OSi/c1-22(2,3)23-24-21-10-6-9-17-13-18-11-15-7-4-5-8-16(15)12-19(18)14-20(17)21/h4-14H,1-3H3
InChIKeyQAXHVLVZIDPFHK-UHFFFAOYSA-N
MW328.49 g/mol
LogP5.21
Rot. Bonds2

About CID 23434735

CID 23434735 (PubChem CID 23434735) has the molecular formula C22H20OSi and a molecular weight of 328.49 g/mol.

Molecular Properties

Compound NameCID 23434735
PubChem CID23434735
Molecular FormulaC22H20OSi
Molecular Weight328.49 g/mol
Exact Mass328.13
IUPAC Name—
SMILESCC(C)(C)O[Si]c1cccc2cc3cc4ccccc4cc3cc12
InChIInChI=1S/C22H20OSi/c1-22(2,3)23-24-21-10-6-9-17-13-18-11-15-7-4-5-8-16(15)12-19(18)14-20(17)21/h4-14H,1-3H3
InChIKeyQAXHVLVZIDPFHK-UHFFFAOYSA-N
XLogP5.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.49
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 23434735?
The IUPAC name of CID 23434735 (CID 23434735) is not available.
What is the SMILES notation for CID 23434735?
The canonical SMILES for CID 23434735 is CC(C)(C)O[Si]c1cccc2cc3cc4ccccc4cc3cc12.
What is the InChIKey of CID 23434735?
The InChIKey is QAXHVLVZIDPFHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20OSi/c1-22(2,3)23-24-21-10-6-9-17-13-18-11-15-7-4-5-8-16(15)12-19(18)14-20(17)21/h4-14H,1-3H3.
What are the key properties of CID 23434735?
CID 23434735 has a molecular weight of 328.49 g/mol, XLogP of 5.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23434735 is sourced from PubChem (CID 23434735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).