holmium(3+);methanesulfonate

C3H9HoO9S3 — CID 141092776

IUPACholmium(3+);methanesulfonate
SMILESCS(=O)(=O)[O-].CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ho+3]
InChIInChI=1S/3CH4O3S.Ho/c3*1-5(2,3)4;/h3*1H3,(H,2,3,4);/q;;;+3/p-3
InChIKeyOKDYXTASMPEXPJ-UHFFFAOYSA-K
MW450.23 g/mol
LogP-2.52
Rot. Bonds

About holmium(3+);methanesulfonate

holmium(3+);methanesulfonate (PubChem CID 141092776) has the molecular formula C3H9HoO9S3 and a molecular weight of 450.23 g/mol. Its IUPAC name is holmium(3+);methanesulfonate.

Molecular Properties

Compound Nameholmium(3+);methanesulfonate
PubChem CID141092776
Molecular FormulaC3H9HoO9S3
Molecular Weight450.23 g/mol
Exact Mass449.87
IUPAC Nameholmium(3+);methanesulfonate
SMILESCS(=O)(=O)[O-].CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ho+3]
InChIInChI=1S/3CH4O3S.Ho/c3*1-5(2,3)4;/h3*1H3,(H,2,3,4);/q;;;+3/p-3
InChIKeyOKDYXTASMPEXPJ-UHFFFAOYSA-K
XLogP-2.52
TPSA171.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.23
LogP ≤ 5-2.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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CID 19881899
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CID 19097166
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CID 173386213
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Frequently Asked Questions

What is the IUPAC name of holmium(3+);methanesulfonate?
The IUPAC name of holmium(3+);methanesulfonate (CID 141092776) is holmium(3+);methanesulfonate.
What is the SMILES notation for holmium(3+);methanesulfonate?
The canonical SMILES for holmium(3+);methanesulfonate is CS(=O)(=O)[O-].CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ho+3].
What is the InChIKey of holmium(3+);methanesulfonate?
The InChIKey is OKDYXTASMPEXPJ-UHFFFAOYSA-K. The full InChI is InChI=1S/3CH4O3S.Ho/c3*1-5(2,3)4;/h3*1H3,(H,2,3,4);/q;;;+3/p-3.
What are the key properties of holmium(3+);methanesulfonate?
holmium(3+);methanesulfonate has a molecular weight of 450.23 g/mol, XLogP of -2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for holmium(3+);methanesulfonate is sourced from PubChem (CID 141092776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).