CID 20681863

C15H45O11Si10 — CID 20681863

IUPAC—
SMILESC[Si]1O[Si](C)(C)O[Si](C)(C)O[Si](C)(O[Si]O[Si](C)(C)O[Si]2(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O2)O1
InChIInChI=1S/C15H45O11Si10/c1-28-18-30(4,5)20-32(8,9)24-35(14,19-28)17-27-16-29(2,3)23-36(15)25-33(10,11)21-31(6,7)22-34(12,13)26-36/h1-15H3
InChIKeyADFQOHBCCOFJHH-UHFFFAOYSA-N
MW682.37 g/mol
LogP4.20
Rot. Bonds6

About CID 20681863

CID 20681863 (PubChem CID 20681863) has the molecular formula C15H45O11Si10 and a molecular weight of 682.37 g/mol.

Molecular Properties

Compound NameCID 20681863
PubChem CID20681863
Molecular FormulaC15H45O11Si10
Molecular Weight682.37 g/mol
Exact Mass681.07
IUPAC Name—
SMILESC[Si]1O[Si](C)(C)O[Si](C)(C)O[Si](C)(O[Si]O[Si](C)(C)O[Si]2(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O2)O1
InChIInChI=1S/C15H45O11Si10/c1-28-18-30(4,5)20-32(8,9)24-35(14,19-28)17-27-16-29(2,3)23-36(15)25-33(10,11)21-31(6,7)22-34(12,13)26-36/h1-15H3
InChIKeyADFQOHBCCOFJHH-UHFFFAOYSA-N
XLogP4.20
TPSA101.53 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500682.37
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

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 20681863?
The IUPAC name of CID 20681863 (CID 20681863) is not available.
What is the SMILES notation for CID 20681863?
The canonical SMILES for CID 20681863 is C[Si]1O[Si](C)(C)O[Si](C)(C)O[Si](C)(O[Si]O[Si](C)(C)O[Si]2(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O2)O1.
What is the InChIKey of CID 20681863?
The InChIKey is ADFQOHBCCOFJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H45O11Si10/c1-28-18-30(4,5)20-32(8,9)24-35(14,19-28)17-27-16-29(2,3)23-36(15)25-33(10,11)21-31(6,7)22-34(12,13)26-36/h1-15H3.
What are the key properties of CID 20681863?
CID 20681863 has a molecular weight of 682.37 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20681863 is sourced from PubChem (CID 20681863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).