CID 58810968

C15H36O5Si4 — CID 58810968

IUPAC—
SMILES[CH]C(CCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C)C(=O)O
InChIInChI=1S/C15H36O5Si4/c1-14(15(16)17)12-11-13-24(10,19-22(5,6)7)20-23(8,9)18-21(2,3)4/h1,14H,11-13H2,2-10H3,(H,16,17)
InChIKeyCYUCYRCWGORJRE-UHFFFAOYSA-N
MW408.79 g/mol
LogP4.67
Rot. Bonds11

About CID 58810968

CID 58810968 (PubChem CID 58810968) has the molecular formula C15H36O5Si4 and a molecular weight of 408.79 g/mol.

Molecular Properties

Compound NameCID 58810968
PubChem CID58810968
Molecular FormulaC15H36O5Si4
Molecular Weight408.79 g/mol
Exact Mass408.16
IUPAC Name—
SMILES[CH]C(CCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C)C(=O)O
InChIInChI=1S/C15H36O5Si4/c1-14(15(16)17)12-11-13-24(10,19-22(5,6)7)20-23(8,9)18-21(2,3)4/h1,14H,11-13H2,2-10H3,(H,16,17)
InChIKeyCYUCYRCWGORJRE-UHFFFAOYSA-N
XLogP4.67
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.79
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 58810968?
The IUPAC name of CID 58810968 (CID 58810968) is not available.
What is the SMILES notation for CID 58810968?
The canonical SMILES for CID 58810968 is [CH]C(CCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C)C(=O)O.
What is the InChIKey of CID 58810968?
The InChIKey is CYUCYRCWGORJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O5Si4/c1-14(15(16)17)12-11-13-24(10,19-22(5,6)7)20-23(8,9)18-21(2,3)4/h1,14H,11-13H2,2-10H3,(H,16,17).
What are the key properties of CID 58810968?
CID 58810968 has a molecular weight of 408.79 g/mol, XLogP of 4.67, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58810968 is sourced from PubChem (CID 58810968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).