[chlorooxy(ethyl)phosphinothioyl] hypochlorite

C2H5Cl2O2PS — CID 57051010

IUPAC[chlorooxy(ethyl)phosphinothioyl] hypochlorite
SMILESCCP(=S)(OCl)OCl
InChIInChI=1S/C2H5Cl2O2PS/c1-2-7(8,5-3)6-4/h2H2,1H3
InChIKeyJMOGQZVIURFJEJ-UHFFFAOYSA-N
MW195.01 g/mol
LogP2.66
Rot. Bonds3

About [chlorooxy(ethyl)phosphinothioyl] hypochlorite

[chlorooxy(ethyl)phosphinothioyl] hypochlorite (PubChem CID 57051010) has the molecular formula C2H5Cl2O2PS and a molecular weight of 195.01 g/mol. Its IUPAC name is [chlorooxy(ethyl)phosphinothioyl] hypochlorite.

Molecular Properties

Compound Name[chlorooxy(ethyl)phosphinothioyl] hypochlorite
PubChem CID57051010
Molecular FormulaC2H5Cl2O2PS
Molecular Weight195.01 g/mol
Exact Mass193.91
IUPAC Name[chlorooxy(ethyl)phosphinothioyl] hypochlorite
SMILESCCP(=S)(OCl)OCl
InChIInChI=1S/C2H5Cl2O2PS/c1-2-7(8,5-3)6-4/h2H2,1H3
InChIKeyJMOGQZVIURFJEJ-UHFFFAOYSA-N
XLogP2.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.01
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[chlorooxy(ethoxy)phosphinothioyl] hypochlorite
CID 20976777
[chlorooxy(ethyl)phosphoryl] hypochlorite
CID 139922572
diethylphosphinothioylmethoxymethyl-diethyl-sulfanylidene-lambda5-phosphane
CID 2785369
chloro-diethoxy-sulfanylidene-λ5-phosphane
CID 160646785
[ethoxy(ethyl)phosphoryl] hypochlorite
CID 87057693
ethoxy-ethyl-sulfanylidene-(2,4,5-trichlorophenoxy)-lambda5-phosphane
CID 9477
ethyl-hydroxy-methyl-sulfanylidene-λ5-phosphane
CID 12608714
butoxy-chloro-ethyl-sulfanylidene-λ5-phosphane
CID 23412944
diethylphosphinothioyl-dimethyl-sulfanylidene-λ5-phosphane
CID 132548484
diethoxy-propyl-sulfanylidene-λ5-phosphane
CID 86135567
ethoxymethyl-diethyl-sulfanylidene-lambda5-phosphane
CID 2784422
aluminum;chloro phosphate;ethanolate
CID 88806976

Frequently Asked Questions

What is the IUPAC name of [chlorooxy(ethyl)phosphinothioyl] hypochlorite?
The IUPAC name of [chlorooxy(ethyl)phosphinothioyl] hypochlorite (CID 57051010) is [chlorooxy(ethyl)phosphinothioyl] hypochlorite.
What is the SMILES notation for [chlorooxy(ethyl)phosphinothioyl] hypochlorite?
The canonical SMILES for [chlorooxy(ethyl)phosphinothioyl] hypochlorite is CCP(=S)(OCl)OCl.
What is the InChIKey of [chlorooxy(ethyl)phosphinothioyl] hypochlorite?
The InChIKey is JMOGQZVIURFJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5Cl2O2PS/c1-2-7(8,5-3)6-4/h2H2,1H3.
What are the key properties of [chlorooxy(ethyl)phosphinothioyl] hypochlorite?
[chlorooxy(ethyl)phosphinothioyl] hypochlorite has a molecular weight of 195.01 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [chlorooxy(ethyl)phosphinothioyl] hypochlorite is sourced from PubChem (CID 57051010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).