strontium methanesulfinate

C2H6O4S2Sr — CID 140863677

IUPACstrontium methanesulfinate
SMILESCS(=O)[O-].CS(=O)[O-].[Sr+2]
InChIInChI=1S/2CH4O2S.Sr/c2*1-4(2)3;/h2*1H3,(H,2,3);/q;;+2/p-2
InChIKeyHUSRWHDXQKDRPF-UHFFFAOYSA-L
MW245.82 g/mol
LogP-1.39
Rot. Bonds

About strontium methanesulfinate

strontium methanesulfinate (PubChem CID 140863677) has the molecular formula C2H6O4S2Sr and a molecular weight of 245.82 g/mol. Its IUPAC name is strontium methanesulfinate.

Molecular Properties

Compound Namestrontium methanesulfinate
PubChem CID140863677
Molecular FormulaC2H6O4S2Sr
Molecular Weight245.82 g/mol
Exact Mass245.88
IUPAC Namestrontium methanesulfinate
SMILESCS(=O)[O-].CS(=O)[O-].[Sr+2]
InChIInChI=1S/2CH4O2S.Sr/c2*1-4(2)3;/h2*1H3,(H,2,3);/q;;+2/p-2
InChIKeyHUSRWHDXQKDRPF-UHFFFAOYSA-L
XLogP-1.39
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.82
LogP ≤ 5-1.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of strontium methanesulfinate?
The IUPAC name of strontium methanesulfinate (CID 140863677) is strontium methanesulfinate.
What is the SMILES notation for strontium methanesulfinate?
The canonical SMILES for strontium methanesulfinate is CS(=O)[O-].CS(=O)[O-].[Sr+2].
What is the InChIKey of strontium methanesulfinate?
The InChIKey is HUSRWHDXQKDRPF-UHFFFAOYSA-L. The full InChI is InChI=1S/2CH4O2S.Sr/c2*1-4(2)3;/h2*1H3,(H,2,3);/q;;+2/p-2.
What are the key properties of strontium methanesulfinate?
strontium methanesulfinate has a molecular weight of 245.82 g/mol, XLogP of -1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for strontium methanesulfinate is sourced from PubChem (CID 140863677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).