CID 22670809

C16H48O9Si10 — CID 22670809

IUPAC
SMILESC[Si](O[Si]O[Si])O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C16H48O9Si10/c1-28(18-27-17-26)19-30(5,6)21-32(9,10)23-34(13,14)25-35(15,16)24-33(11,12)22-31(7,8)20-29(2,3)4/h1-16H3
InChIKeyKLRTXNDPBPSZJW-UHFFFAOYSA-N
MW665.41 g/mol
LogP4.92
Rot. Bonds17

About CID 22670809

CID 22670809 (PubChem CID 22670809) has the molecular formula C16H48O9Si10 and a molecular weight of 665.41 g/mol.

Molecular Properties

Compound NameCID 22670809
PubChem CID22670809
Molecular FormulaC16H48O9Si10
Molecular Weight665.41 g/mol
Exact Mass664.10
IUPAC Name
SMILESC[Si](O[Si]O[Si])O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C16H48O9Si10/c1-28(18-27-17-26)19-30(5,6)21-32(9,10)23-34(13,14)25-35(15,16)24-33(11,12)22-31(7,8)20-29(2,3)4/h1-16H3
InChIKeyKLRTXNDPBPSZJW-UHFFFAOYSA-N
XLogP4.92
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds17
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500665.41
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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 22670809?
The IUPAC name of CID 22670809 (CID 22670809) is not available.
What is the SMILES notation for CID 22670809?
The canonical SMILES for CID 22670809 is C[Si](O[Si]O[Si])O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of CID 22670809?
The InChIKey is KLRTXNDPBPSZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H48O9Si10/c1-28(18-27-17-26)19-30(5,6)21-32(9,10)23-34(13,14)25-35(15,16)24-33(11,12)22-31(7,8)20-29(2,3)4/h1-16H3.
What are the key properties of CID 22670809?
CID 22670809 has a molecular weight of 665.41 g/mol, XLogP of 4.92, 17 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22670809 is sourced from PubChem (CID 22670809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).