dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane

C4H3Cl2OPS2 — CID 172687335

IUPACdichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane
SMILESS=P(Cl)(Cl)Oc1cccs1
InChIInChI=1S/C4H3Cl2OPS2/c5-8(6,9)7-4-2-1-3-10-4/h1-3H
InChIKeyBFDPWBTUBFXONG-UHFFFAOYSA-N
MW233.08 g/mol
LogP3.83
Rot. Bonds2

About dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane

dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane (PubChem CID 172687335) has the molecular formula C4H3Cl2OPS2 and a molecular weight of 233.08 g/mol. Its IUPAC name is dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane.

Molecular Properties

Compound Namedichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane
PubChem CID172687335
Molecular FormulaC4H3Cl2OPS2
Molecular Weight233.08 g/mol
Exact Mass231.87
IUPAC Namedichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane
SMILESS=P(Cl)(Cl)Oc1cccs1
InChIInChI=1S/C4H3Cl2OPS2/c5-8(6,9)7-4-2-1-3-10-4/h1-3H
InChIKeyBFDPWBTUBFXONG-UHFFFAOYSA-N
XLogP3.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.08
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane?
The IUPAC name of dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane (CID 172687335) is dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane.
What is the SMILES notation for dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane?
The canonical SMILES for dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane is S=P(Cl)(Cl)Oc1cccs1.
What is the InChIKey of dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane?
The InChIKey is BFDPWBTUBFXONG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3Cl2OPS2/c5-8(6,9)7-4-2-1-3-10-4/h1-3H.
What are the key properties of dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane?
dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane has a molecular weight of 233.08 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-sulfanylidene-thiophen-2-yloxy-λ5-phosphane is sourced from PubChem (CID 172687335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).