CID 70231673

C28H24O3Si2 — CID 70231673

IUPAC—
SMILES[Si]CC(OC(C[Si])c1cccc(Oc2ccccc2)c1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C28H24O3Si2/c32-19-27(21-9-7-15-25(17-21)29-23-11-3-1-4-12-23)31-28(20-33)22-10-8-16-26(18-22)30-24-13-5-2-6-14-24/h1-18,27-28H,19-20H2
InChIKeyZRKRJSMQOPUNPB-UHFFFAOYSA-N
MW464.67 g/mol
LogP7.24
Rot. Bonds10

About CID 70231673

CID 70231673 (PubChem CID 70231673) has the molecular formula C28H24O3Si2 and a molecular weight of 464.67 g/mol.

Molecular Properties

Compound NameCID 70231673
PubChem CID70231673
Molecular FormulaC28H24O3Si2
Molecular Weight464.67 g/mol
Exact Mass464.13
IUPAC Name—
SMILES[Si]CC(OC(C[Si])c1cccc(Oc2ccccc2)c1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C28H24O3Si2/c32-19-27(21-9-7-15-25(17-21)29-23-11-3-1-4-12-23)31-28(20-33)22-10-8-16-26(18-22)30-24-13-5-2-6-14-24/h1-18,27-28H,19-20H2
InChIKeyZRKRJSMQOPUNPB-UHFFFAOYSA-N
XLogP7.24
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.67
LogP ≤ 57.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 70231673?
The IUPAC name of CID 70231673 (CID 70231673) is not available.
What is the SMILES notation for CID 70231673?
The canonical SMILES for CID 70231673 is [Si]CC(OC(C[Si])c1cccc(Oc2ccccc2)c1)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of CID 70231673?
The InChIKey is ZRKRJSMQOPUNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24O3Si2/c32-19-27(21-9-7-15-25(17-21)29-23-11-3-1-4-12-23)31-28(20-33)22-10-8-16-26(18-22)30-24-13-5-2-6-14-24/h1-18,27-28H,19-20H2.
What are the key properties of CID 70231673?
CID 70231673 has a molecular weight of 464.67 g/mol, XLogP of 7.24, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70231673 is sourced from PubChem (CID 70231673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).