Propane-2-thiol--plumbane (1/1)

C3H8PbS — CID 54602642

IUPAC—
SMILESCC(C)S.[Pb]
InChIInChI=1S/C3H8S.Pb/c1-3(2)4;/h3-4H,1-2H3;
InChIKeyKQTGNYNSKKYLLE-UHFFFAOYSA-N
MW283.36 g/mol
LogP0.94
Rot. Bonds

About Propane-2-thiol--plumbane (1/1)

Propane-2-thiol--plumbane (1/1) (PubChem CID 54602642) has the molecular formula C3H8PbS and a molecular weight of 283.36 g/mol.

Molecular Properties

Compound NamePropane-2-thiol--plumbane (1/1)
PubChem CID54602642
Molecular FormulaC3H8PbS
Molecular Weight283.36 g/mol
Exact Mass284.01
IUPAC Name—
SMILESCC(C)S.[Pb]
InChIInChI=1S/C3H8S.Pb/c1-3(2)4;/h3-4H,1-2H3;
InChIKeyKQTGNYNSKKYLLE-UHFFFAOYSA-N
XLogP0.94
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Propane-2-thiol--plumbane (1/1)?
The IUPAC name of Propane-2-thiol--plumbane (1/1) (CID 54602642) is not available.
What is the SMILES notation for Propane-2-thiol--plumbane (1/1)?
The canonical SMILES for Propane-2-thiol--plumbane (1/1) is CC(C)S.[Pb].
What is the InChIKey of Propane-2-thiol--plumbane (1/1)?
The InChIKey is KQTGNYNSKKYLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8S.Pb/c1-3(2)4;/h3-4H,1-2H3;.
What are the key properties of Propane-2-thiol--plumbane (1/1)?
Propane-2-thiol--plumbane (1/1) has a molecular weight of 283.36 g/mol, XLogP of 0.94, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Propane-2-thiol--plumbane (1/1) is sourced from PubChem (CID 54602642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).