CID 58830713

C14H39O6Si5 — CID 58830713

IUPAC—
SMILESCO[Si](C)(O[Si](C)[Si](C)(C)CC(C)(C)O)O[Si](C)(OC)O[Si](C)(C)C
InChIInChI=1S/C14H39O6Si5/c1-14(2,15)13-23(9,10)21(5)18-24(11,16-3)20-25(12,17-4)19-22(6,7)8/h15H,13H2,1-12H3
InChIKeyRELXTBOWBXDZLA-UHFFFAOYSA-N
MW443.89 g/mol
LogP3.48
Rot. Bonds11

About CID 58830713

CID 58830713 (PubChem CID 58830713) has the molecular formula C14H39O6Si5 and a molecular weight of 443.89 g/mol.

Molecular Properties

Compound NameCID 58830713
PubChem CID58830713
Molecular FormulaC14H39O6Si5
Molecular Weight443.89 g/mol
Exact Mass443.16
IUPAC Name—
SMILESCO[Si](C)(O[Si](C)[Si](C)(C)CC(C)(C)O)O[Si](C)(OC)O[Si](C)(C)C
InChIInChI=1S/C14H39O6Si5/c1-14(2,15)13-23(9,10)21(5)18-24(11,16-3)20-25(12,17-4)19-22(6,7)8/h15H,13H2,1-12H3
InChIKeyRELXTBOWBXDZLA-UHFFFAOYSA-N
XLogP3.48
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.89
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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 58830713?
The IUPAC name of CID 58830713 (CID 58830713) is not available.
What is the SMILES notation for CID 58830713?
The canonical SMILES for CID 58830713 is CO[Si](C)(O[Si](C)[Si](C)(C)CC(C)(C)O)O[Si](C)(OC)O[Si](C)(C)C.
What is the InChIKey of CID 58830713?
The InChIKey is RELXTBOWBXDZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H39O6Si5/c1-14(2,15)13-23(9,10)21(5)18-24(11,16-3)20-25(12,17-4)19-22(6,7)8/h15H,13H2,1-12H3.
What are the key properties of CID 58830713?
CID 58830713 has a molecular weight of 443.89 g/mol, XLogP of 3.48, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58830713 is sourced from PubChem (CID 58830713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).