octanoate;rubidium(1+)

C8H15O2Rb — CID 23682003

IUPACoctanoate;rubidium(1+)
SMILESCCCCCCCC(=O)[O-].[Rb+]
InChIInChI=1S/C8H16O2.Rb/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1
InChIKeyDFAVZOANBPHLHF-UHFFFAOYSA-M
MW228.67 g/mol
LogP-1.90
Rot. Bonds6

About octanoate;rubidium(1+)

octanoate;rubidium(1+) (PubChem CID 23682003) has the molecular formula C8H15O2Rb and a molecular weight of 228.67 g/mol. Its IUPAC name is octanoate;rubidium(1+).

Molecular Properties

Compound Nameoctanoate;rubidium(1+)
PubChem CID23682003
Molecular FormulaC8H15O2Rb
Molecular Weight228.67 g/mol
Exact Mass228.02
IUPAC Nameoctanoate;rubidium(1+)
SMILESCCCCCCCC(=O)[O-].[Rb+]
InChIInChI=1S/C8H16O2.Rb/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1
InChIKeyDFAVZOANBPHLHF-UHFFFAOYSA-M
XLogP-1.90
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.67
LogP ≤ 5-1.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of octanoate;rubidium(1+)?
The IUPAC name of octanoate;rubidium(1+) (CID 23682003) is octanoate;rubidium(1+).
What is the SMILES notation for octanoate;rubidium(1+)?
The canonical SMILES for octanoate;rubidium(1+) is CCCCCCCC(=O)[O-].[Rb+].
What is the InChIKey of octanoate;rubidium(1+)?
The InChIKey is DFAVZOANBPHLHF-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H16O2.Rb/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1.
What are the key properties of octanoate;rubidium(1+)?
octanoate;rubidium(1+) has a molecular weight of 228.67 g/mol, XLogP of -1.90, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for octanoate;rubidium(1+) is sourced from PubChem (CID 23682003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).