dichloro(ethylsulfanyl)phosphane

C2H5Cl2PS — CID 12539851

IUPACdichloro(ethylsulfanyl)phosphane
SMILESCCSP(Cl)Cl
InChIInChI=1S/C2H5Cl2PS/c1-2-6-5(3)4/h2H2,1H3
InChIKeyMHDMEKQBHYQBRK-UHFFFAOYSA-N
MW163.01 g/mol
LogP3.44
Rot. Bonds2

About dichloro(ethylsulfanyl)phosphane

dichloro(ethylsulfanyl)phosphane (PubChem CID 12539851) has the molecular formula C2H5Cl2PS and a molecular weight of 163.01 g/mol. Its IUPAC name is dichloro(ethylsulfanyl)phosphane.

Molecular Properties

Compound Namedichloro(ethylsulfanyl)phosphane
PubChem CID12539851
Molecular FormulaC2H5Cl2PS
Molecular Weight163.01 g/mol
Exact Mass161.92
IUPAC Namedichloro(ethylsulfanyl)phosphane
SMILESCCSP(Cl)Cl
InChIInChI=1S/C2H5Cl2PS/c1-2-6-5(3)4/h2H2,1H3
InChIKeyMHDMEKQBHYQBRK-UHFFFAOYSA-N
XLogP3.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.01
LogP ≤ 53.44
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(ethylsulfanyl)phosphane?
The IUPAC name of dichloro(ethylsulfanyl)phosphane (CID 12539851) is dichloro(ethylsulfanyl)phosphane.
What is the SMILES notation for dichloro(ethylsulfanyl)phosphane?
The canonical SMILES for dichloro(ethylsulfanyl)phosphane is CCSP(Cl)Cl.
What is the InChIKey of dichloro(ethylsulfanyl)phosphane?
The InChIKey is MHDMEKQBHYQBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5Cl2PS/c1-2-6-5(3)4/h2H2,1H3.
What are the key properties of dichloro(ethylsulfanyl)phosphane?
dichloro(ethylsulfanyl)phosphane has a molecular weight of 163.01 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(ethylsulfanyl)phosphane is sourced from PubChem (CID 12539851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).