dilithium bis(ethylsulfanyl-oxido-oxophosphanium)

C4H10Li2O4P2S2+2 — CID 57351004

IUPACdilithium bis(ethylsulfanyl-oxido-oxophosphanium)
SMILESCCS[P+](=O)[O-].CCS[P+](=O)[O-].[Li+].[Li+]
InChIInChI=1S/2C2H5O2PS.2Li/c2*1-2-6-5(3)4;;/h2*2H2,1H3;;/q;;2*+1
InChIKeyDZXHJFRRFWOZQF-UHFFFAOYSA-N
MW262.08 g/mol
LogP-4.48
Rot. Bonds4

About dilithium bis(ethylsulfanyl-oxido-oxophosphanium)

dilithium bis(ethylsulfanyl-oxido-oxophosphanium) (PubChem CID 57351004) has the molecular formula C4H10Li2O4P2S2+2 and a molecular weight of 262.08 g/mol. Its IUPAC name is dilithium bis(ethylsulfanyl-oxido-oxophosphanium).

Molecular Properties

Compound Namedilithium bis(ethylsulfanyl-oxido-oxophosphanium)
PubChem CID57351004
Molecular FormulaC4H10Li2O4P2S2+2
Molecular Weight262.08 g/mol
Exact Mass261.98
IUPAC Namedilithium bis(ethylsulfanyl-oxido-oxophosphanium)
SMILESCCS[P+](=O)[O-].CCS[P+](=O)[O-].[Li+].[Li+]
InChIInChI=1S/2C2H5O2PS.2Li/c2*1-2-6-5(3)4;;/h2*2H2,1H3;;/q;;2*+1
InChIKeyDZXHJFRRFWOZQF-UHFFFAOYSA-N
XLogP-4.48
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.08
LogP ≤ 5-4.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dilithium bis(ethylsulfanyl-oxido-oxophosphanium)?
The IUPAC name of dilithium bis(ethylsulfanyl-oxido-oxophosphanium) (CID 57351004) is dilithium bis(ethylsulfanyl-oxido-oxophosphanium).
What is the SMILES notation for dilithium bis(ethylsulfanyl-oxido-oxophosphanium)?
The canonical SMILES for dilithium bis(ethylsulfanyl-oxido-oxophosphanium) is CCS[P+](=O)[O-].CCS[P+](=O)[O-].[Li+].[Li+].
What is the InChIKey of dilithium bis(ethylsulfanyl-oxido-oxophosphanium)?
The InChIKey is DZXHJFRRFWOZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5O2PS.2Li/c2*1-2-6-5(3)4;;/h2*2H2,1H3;;/q;;2*+1.
What are the key properties of dilithium bis(ethylsulfanyl-oxido-oxophosphanium)?
dilithium bis(ethylsulfanyl-oxido-oxophosphanium) has a molecular weight of 262.08 g/mol, XLogP of -4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium bis(ethylsulfanyl-oxido-oxophosphanium) is sourced from PubChem (CID 57351004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).