octanoic acid;rhodium(3+)

C8H16O2Rh+3 — CID 57349770

IUPACoctanoic acid;rhodium(3+)
SMILESCCCCCCCC(=O)O.[Rh+3]
InChIInChI=1S/C8H16O2.Rh/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+3
InChIKeyJXBNZWCGKNZNLT-UHFFFAOYSA-N
MW247.12 g/mol
LogP2.43
Rot. Bonds6

About octanoic acid;rhodium(3+)

octanoic acid;rhodium(3+) (PubChem CID 57349770) has the molecular formula C8H16O2Rh+3 and a molecular weight of 247.12 g/mol. Its IUPAC name is octanoic acid;rhodium(3+).

Molecular Properties

Compound Nameoctanoic acid;rhodium(3+)
PubChem CID57349770
Molecular FormulaC8H16O2Rh+3
Molecular Weight247.12 g/mol
Exact Mass247.02
IUPAC Nameoctanoic acid;rhodium(3+)
SMILESCCCCCCCC(=O)O.[Rh+3]
InChIInChI=1S/C8H16O2.Rh/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+3
InChIKeyJXBNZWCGKNZNLT-UHFFFAOYSA-N
XLogP2.43
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.12
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

bis(decanoic acid);bis(octanoic acid)
CID 160578094
decanoic acid;bis(nonanoic acid)
CID 159376136
henicosane;tetracontanoic acid
CID 175935348
henicosane;tricosanoic acid
CID 175935357
decanoic acid;tetradecanoic acid
CID 87611521
decanoic acid;dodecanoic acid;hexadecanoic acid;octanoic acid;tetradecanoic acid
CID 159524024
decanoic acid;bis(dodecanoic acid)
CID 88765096
bis(hexanedioic acid);bis(tridecane)
CID 173306988
decanedioic acid;nonane
CID 25154161
decanoic acid
CID 158633075
decanoic acid;hexanedioic acid
CID 87189912
dodecanoic acid
CID 158187269

Frequently Asked Questions

What is the IUPAC name of octanoic acid;rhodium(3+)?
The IUPAC name of octanoic acid;rhodium(3+) (CID 57349770) is octanoic acid;rhodium(3+).
What is the SMILES notation for octanoic acid;rhodium(3+)?
The canonical SMILES for octanoic acid;rhodium(3+) is CCCCCCCC(=O)O.[Rh+3].
What is the InChIKey of octanoic acid;rhodium(3+)?
The InChIKey is JXBNZWCGKNZNLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2.Rh/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+3.
What are the key properties of octanoic acid;rhodium(3+)?
octanoic acid;rhodium(3+) has a molecular weight of 247.12 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for octanoic acid;rhodium(3+) is sourced from PubChem (CID 57349770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).