O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine

C2H8NO2PS2 — CID 174299103

IUPACO-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine
SMILESCCSP(O)(=S)ON
InChIInChI=1S/C2H8NO2PS2/c1-2-8-6(4,7)5-3/h2-3H2,1H3,(H,4,7)
InChIKeySTGPUIIROVSZBU-UHFFFAOYSA-N
MW173.20 g/mol
LogP0.85
Rot. Bonds3

About O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine

O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine (PubChem CID 174299103) has the molecular formula C2H8NO2PS2 and a molecular weight of 173.20 g/mol. Its IUPAC name is O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine.

Molecular Properties

Compound NameO-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine
PubChem CID174299103
Molecular FormulaC2H8NO2PS2
Molecular Weight173.20 g/mol
Exact Mass172.97
IUPAC NameO-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine
SMILESCCSP(O)(=S)ON
InChIInChI=1S/C2H8NO2PS2/c1-2-8-6(4,7)5-3/h2-3H2,1H3,(H,4,7)
InChIKeySTGPUIIROVSZBU-UHFFFAOYSA-N
XLogP0.85
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.20
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine?
The IUPAC name of O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine (CID 174299103) is O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine.
What is the SMILES notation for O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine?
The canonical SMILES for O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine is CCSP(O)(=S)ON.
What is the InChIKey of O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine?
The InChIKey is STGPUIIROVSZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8NO2PS2/c1-2-8-6(4,7)5-3/h2-3H2,1H3,(H,4,7).
What are the key properties of O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine?
O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine has a molecular weight of 173.20 g/mol, XLogP of 0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[ethylsulfanyl(hydroxy)phosphinothioyl]hydroxylamine is sourced from PubChem (CID 174299103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).