dichloro-phenyl-sulfanylidene-lambda5-phosphane

C6H5Cl2PS — CID 19016

IUPACdichloro-phenyl-sulfanylidene-lambda5-phosphane
SMILESS=P(Cl)(Cl)c1ccccc1
InChIInChI=1S/C6H5Cl2PS/c7-9(8,10)6-4-2-1-3-5-6/h1-5H
InChIKeySXIWNIQDOJKDGB-UHFFFAOYSA-N
MW211.05 g/mol
LogP3.10
Rot. Bonds1

About dichloro-phenyl-sulfanylidene-lambda5-phosphane

dichloro-phenyl-sulfanylidene-lambda5-phosphane (PubChem CID 19016) has the molecular formula C6H5Cl2PS and a molecular weight of 211.05 g/mol. Its IUPAC name is dichloro-phenyl-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Namedichloro-phenyl-sulfanylidene-lambda5-phosphane
PubChem CID19016
Molecular FormulaC6H5Cl2PS
Molecular Weight211.05 g/mol
Exact Mass209.92
IUPAC Namedichloro-phenyl-sulfanylidene-lambda5-phosphane
SMILESS=P(Cl)(Cl)c1ccccc1
InChIInChI=1S/C6H5Cl2PS/c7-9(8,10)6-4-2-1-3-5-6/h1-5H
InChIKeySXIWNIQDOJKDGB-UHFFFAOYSA-N
XLogP3.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.05
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-phenyl-sulfanylidene-lambda5-phosphane?
The IUPAC name of dichloro-phenyl-sulfanylidene-lambda5-phosphane (CID 19016) is dichloro-phenyl-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for dichloro-phenyl-sulfanylidene-lambda5-phosphane?
The canonical SMILES for dichloro-phenyl-sulfanylidene-lambda5-phosphane is S=P(Cl)(Cl)c1ccccc1.
What is the InChIKey of dichloro-phenyl-sulfanylidene-lambda5-phosphane?
The InChIKey is SXIWNIQDOJKDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2PS/c7-9(8,10)6-4-2-1-3-5-6/h1-5H.
What are the key properties of dichloro-phenyl-sulfanylidene-lambda5-phosphane?
dichloro-phenyl-sulfanylidene-lambda5-phosphane has a molecular weight of 211.05 g/mol, XLogP of 3.10, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-phenyl-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 19016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).