CID 11341243

C28H38O5Si2 — CID 11341243

IUPAC—
SMILESCC(C)(C)C(C)(C)[Si]Oc1ccc(-c2coc3cc(O[Si](C)(C)C(C)(C)C)cc(O)c3c2=O)cc1
InChIInChI=1S/C28H38O5Si2/c1-26(2,3)28(7,8)34-32-19-13-11-18(12-14-19)21-17-31-23-16-20(15-22(29)24(23)25(21)30)33-35(9,10)27(4,5)6/h11-17,29H,1-10H3
InChIKeyPITQDDSLUPUAQI-UHFFFAOYSA-N
MW510.78 g/mol
LogP7.79
Rot. Bonds6

About CID 11341243

CID 11341243 (PubChem CID 11341243) has the molecular formula C28H38O5Si2 and a molecular weight of 510.78 g/mol.

Molecular Properties

Compound NameCID 11341243
PubChem CID11341243
Molecular FormulaC28H38O5Si2
Molecular Weight510.78 g/mol
Exact Mass510.23
IUPAC Name—
SMILESCC(C)(C)C(C)(C)[Si]Oc1ccc(-c2coc3cc(O[Si](C)(C)C(C)(C)C)cc(O)c3c2=O)cc1
InChIInChI=1S/C28H38O5Si2/c1-26(2,3)28(7,8)34-32-19-13-11-18(12-14-19)21-17-31-23-16-20(15-22(29)24(23)25(21)30)33-35(9,10)27(4,5)6/h11-17,29H,1-10H3
InChIKeyPITQDDSLUPUAQI-UHFFFAOYSA-N
XLogP7.79
TPSA68.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.78
LogP ≤ 57.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 11341243?
The IUPAC name of CID 11341243 (CID 11341243) is not available.
What is the SMILES notation for CID 11341243?
The canonical SMILES for CID 11341243 is CC(C)(C)C(C)(C)[Si]Oc1ccc(-c2coc3cc(O[Si](C)(C)C(C)(C)C)cc(O)c3c2=O)cc1.
What is the InChIKey of CID 11341243?
The InChIKey is PITQDDSLUPUAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H38O5Si2/c1-26(2,3)28(7,8)34-32-19-13-11-18(12-14-19)21-17-31-23-16-20(15-22(29)24(23)25(21)30)33-35(9,10)27(4,5)6/h11-17,29H,1-10H3.
What are the key properties of CID 11341243?
CID 11341243 has a molecular weight of 510.78 g/mol, XLogP of 7.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11341243 is sourced from PubChem (CID 11341243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).