[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane

C4H11PS — CID 137482561

IUPAC[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane
SMILES[H]/P=S(\C)C(C)C
InChIInChI=1S/C4H11PS/c1-4(2)6(3)5/h4-5H,1-3H3
InChIKeyVLLREFDQWKRSSM-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.70
Rot. Bonds1

About [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane

[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane (PubChem CID 137482561) has the molecular formula C4H11PS and a molecular weight of 122.17 g/mol. Its IUPAC name is [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane.

Molecular Properties

Compound Name[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane
PubChem CID137482561
Molecular FormulaC4H11PS
Molecular Weight122.17 g/mol
Exact Mass122.03
IUPAC Name[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane
SMILES[H]/P=S(\C)C(C)C
InChIInChI=1S/C4H11PS/c1-4(2)6(3)5/h4-5H,1-3H3
InChIKeyVLLREFDQWKRSSM-UHFFFAOYSA-N
XLogP1.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane?
The IUPAC name of [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane (CID 137482561) is [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane.
What is the SMILES notation for [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane?
The canonical SMILES for [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane is [H]/P=S(\C)C(C)C.
What is the InChIKey of [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane?
The InChIKey is VLLREFDQWKRSSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11PS/c1-4(2)6(3)5/h4-5H,1-3H3.
What are the key properties of [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane?
[methyl(propan-2-yl)-λ4-sulfanylidene]phosphane has a molecular weight of 122.17 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl(propan-2-yl)-λ4-sulfanylidene]phosphane is sourced from PubChem (CID 137482561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).