methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane

C2H7OPS3 — CID 15917224

IUPACmethoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane
SMILESCOP(=S)(S)SC
InChIInChI=1S/C2H7OPS3/c1-3-4(5,6)7-2/h1-2H3,(H,5,6)
InChIKeyYZBWUGZBUWRZLS-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.15
Rot. Bonds2

About methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane

methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane (PubChem CID 15917224) has the molecular formula C2H7OPS3 and a molecular weight of 174.25 g/mol. Its IUPAC name is methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Namemethoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane
PubChem CID15917224
Molecular FormulaC2H7OPS3
Molecular Weight174.25 g/mol
Exact Mass173.94
IUPAC Namemethoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane
SMILESCOP(=S)(S)SC
InChIInChI=1S/C2H7OPS3/c1-3-4(5,6)7-2/h1-2H3,(H,5,6)
InChIKeyYZBWUGZBUWRZLS-UHFFFAOYSA-N
XLogP2.15
TPSA9.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane?
The IUPAC name of methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane (CID 15917224) is methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane?
The canonical SMILES for methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane is COP(=S)(S)SC.
What is the InChIKey of methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane?
The InChIKey is YZBWUGZBUWRZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7OPS3/c1-3-4(5,6)7-2/h1-2H3,(H,5,6).
What are the key properties of methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane?
methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane has a molecular weight of 174.25 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-methylsulfanyl-sulfanyl-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 15917224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).