dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane

C3H11PS2 — CID 159988890

IUPACdimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane
SMILESC.CP(C)(=S)S
InChIInChI=1S/C2H7PS2.CH4/c1-3(2,4)5;/h1-2H3,(H,4,5);1H4
InChIKeyOGROCWQCUPCCKT-UHFFFAOYSA-N
MW142.23 g/mol
LogP2.21
Rot. Bonds

About dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane

dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane (PubChem CID 159988890) has the molecular formula C3H11PS2 and a molecular weight of 142.23 g/mol. Its IUPAC name is dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane.

Molecular Properties

Compound Namedimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane
PubChem CID159988890
Molecular FormulaC3H11PS2
Molecular Weight142.23 g/mol
Exact Mass142.00
IUPAC Namedimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane
SMILESC.CP(C)(=S)S
InChIInChI=1S/C2H7PS2.CH4/c1-3(2,4)5;/h1-2H3,(H,4,5);1H4
InChIKeyOGROCWQCUPCCKT-UHFFFAOYSA-N
XLogP2.21
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dichloro-sulfanyl-sulfanylidene-λ5-phosphane
CID 11080841
azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 175740324
azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 23205543
ethane;methane;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 175324813
dimethylphosphinic acid;hydroxy-dimethyl-sulfanylidene-λ5-phosphane;methane;methylphosphonic acid
CID 159434045
ethenyl-hydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 154162230
methane;prop-1-ene;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 173442246
methyl-phenyl-sulfanyl-sulfanylidene-lambda5-phosphane
CID 586594
methyl-propylsulfanyl-sulfanyl-sulfanylidene-λ5-phosphane
CID 21116234
dimethylphosphinothioylsulfanyl-dimethyl-sulfanylidene-λ5-phosphane
CID 23414001
dimethylarsanyl-dimethyl-sulfanylidene-λ5-phosphane
CID 23270899
chloro-fluoro-methyl-sulfanylidene-lambda5-phosphane
CID 583465

Frequently Asked Questions

What is the IUPAC name of dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane?
The IUPAC name of dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane (CID 159988890) is dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane.
What is the SMILES notation for dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane?
The canonical SMILES for dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane is C.CP(C)(=S)S.
What is the InChIKey of dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane?
The InChIKey is OGROCWQCUPCCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7PS2.CH4/c1-3(2,4)5;/h1-2H3,(H,4,5);1H4.
What are the key properties of dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane?
dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane has a molecular weight of 142.23 g/mol, XLogP of 2.21, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-sulfanyl-sulfanylidene-λ5-phosphane;methane is sourced from PubChem (CID 159988890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).