ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)

C4H10NiO2PS2+ — CID 21151066

IUPACethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)
SMILESCCOP([O-])(=S)SCC.[Ni+2]
InChIInChI=1S/C4H11O2PS2.Ni/c1-3-6-7(5,8)9-4-2;/h3-4H2,1-2H3,(H,5,8);/q;+2/p-1
InChIKeyQEHNATFMFSYUHS-UHFFFAOYSA-M
MW243.92 g/mol
LogP1.36
Rot. Bonds4

About ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)

ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+) (PubChem CID 21151066) has the molecular formula C4H10NiO2PS2+ and a molecular weight of 243.92 g/mol. Its IUPAC name is ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+).

Molecular Properties

Compound Nameethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)
PubChem CID21151066
Molecular FormulaC4H10NiO2PS2+
Molecular Weight243.92 g/mol
Exact Mass242.92
IUPAC Nameethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)
SMILESCCOP([O-])(=S)SCC.[Ni+2]
InChIInChI=1S/C4H11O2PS2.Ni/c1-3-6-7(5,8)9-4-2;/h3-4H2,1-2H3,(H,5,8);/q;+2/p-1
InChIKeyQEHNATFMFSYUHS-UHFFFAOYSA-M
XLogP1.36
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.92
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

potassium butylsulfanyl-ethoxy-oxido-sulfanylidene-λ5-phosphane
CID 88816879
potassium ethoxy-(3-methoxypropylsulfanyl)-oxido-sulfanylidene-λ5-phosphane
CID 23671261
potassium benzylsulfanyl-ethoxy-oxido-sulfanylidene-λ5-phosphane
CID 70633644
potassium butan-2-ylsulfanyl-ethoxy-oxido-sulfanylidene-λ5-phosphane
CID 23699412
antimony(3+);tris(oxido-propoxy-propylsulfanyl-sulfanylidene-λ5-phosphane)
CID 175173432
[ethoxy(ethylsulfanyl)phosphinothioyl] diethyl phosphate
CID 22497723
zinc bis(octoxy-oxido-propylsulfanyl-sulfanylidene-λ5-phosphane)
CID 162084405
(diethoxyphosphinothioyltetrasulfanyl)-diethoxy-sulfanylidene-lambda5-phosphane
CID 12506612
diethoxy-methanidyl-sulfanylidene-λ5-phosphane
CID 23416615
tetrasodium ethyl phosphate
CID 141178132
dichloro-ethylsulfanyl-sulfanylidene-lambda5-phosphane
CID 519205
diethoxy-sulfanyl-sulfanylidene-λ5-phosphane;sulfane
CID 173229302

Frequently Asked Questions

What is the IUPAC name of ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)?
The IUPAC name of ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+) (CID 21151066) is ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+).
What is the SMILES notation for ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)?
The canonical SMILES for ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+) is CCOP([O-])(=S)SCC.[Ni+2].
What is the InChIKey of ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)?
The InChIKey is QEHNATFMFSYUHS-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H11O2PS2.Ni/c1-3-6-7(5,8)9-4-2;/h3-4H2,1-2H3,(H,5,8);/q;+2/p-1.
What are the key properties of ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+)?
ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+) has a molecular weight of 243.92 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-ethylsulfanyl-oxido-sulfanylidene-λ5-phosphane;nickel(2+) is sourced from PubChem (CID 21151066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).