CID 59392047

C8H18O2Rb2Si+ — CID 59392047

IUPAC—
SMILESCC(C)(C)O[Si-]OC(C)(C)C.[Rb+].[Rb+]
InChIInChI=1S/C8H18O2Si.2Rb/c1-7(2,3)9-11-10-8(4,5)6;;/h1-6H3;;/q-1;2*+1
InChIKeyAEQPGVCEGOSLHD-UHFFFAOYSA-N
MW345.25 g/mol
LogP-3.84
Rot. Bonds2

About CID 59392047

CID 59392047 (PubChem CID 59392047) has the molecular formula C8H18O2Rb2Si+ and a molecular weight of 345.25 g/mol.

Molecular Properties

Compound NameCID 59392047
PubChem CID59392047
Molecular FormulaC8H18O2Rb2Si+
Molecular Weight345.25 g/mol
Exact Mass343.93
IUPAC Name—
SMILESCC(C)(C)O[Si-]OC(C)(C)C.[Rb+].[Rb+]
InChIInChI=1S/C8H18O2Si.2Rb/c1-7(2,3)9-11-10-8(4,5)6;;/h1-6H3;;/q-1;2*+1
InChIKeyAEQPGVCEGOSLHD-UHFFFAOYSA-N
XLogP-3.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.25
LogP ≤ 5-3.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 59392047?
The IUPAC name of CID 59392047 (CID 59392047) is not available.
What is the SMILES notation for CID 59392047?
The canonical SMILES for CID 59392047 is CC(C)(C)O[Si-]OC(C)(C)C.[Rb+].[Rb+].
What is the InChIKey of CID 59392047?
The InChIKey is AEQPGVCEGOSLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2Si.2Rb/c1-7(2,3)9-11-10-8(4,5)6;;/h1-6H3;;/q-1;2*+1.
What are the key properties of CID 59392047?
CID 59392047 has a molecular weight of 345.25 g/mol, XLogP of -3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59392047 is sourced from PubChem (CID 59392047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).