tert-butyl(ethylsulfanyl)phosphane

C6H15PS — CID 16699435

IUPACtert-butyl(ethylsulfanyl)phosphane
SMILESCCSPC(C)(C)C
InChIInChI=1S/C6H15PS/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3
InChIKeyDGZCNQLYBWZAEO-UHFFFAOYSA-N
MW150.23 g/mol
LogP3.13
Rot. Bonds2

About tert-butyl(ethylsulfanyl)phosphane

tert-butyl(ethylsulfanyl)phosphane (PubChem CID 16699435) has the molecular formula C6H15PS and a molecular weight of 150.23 g/mol. Its IUPAC name is tert-butyl(ethylsulfanyl)phosphane.

Molecular Properties

Compound Nametert-butyl(ethylsulfanyl)phosphane
PubChem CID16699435
Molecular FormulaC6H15PS
Molecular Weight150.23 g/mol
Exact Mass150.06
IUPAC Nametert-butyl(ethylsulfanyl)phosphane
SMILESCCSPC(C)(C)C
InChIInChI=1S/C6H15PS/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3
InChIKeyDGZCNQLYBWZAEO-UHFFFAOYSA-N
XLogP3.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.23
LogP ≤ 53.13
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 tert-butyl(ethylsulfanyl)phosphane?
The IUPAC name of tert-butyl(ethylsulfanyl)phosphane (CID 16699435) is tert-butyl(ethylsulfanyl)phosphane.
What is the SMILES notation for tert-butyl(ethylsulfanyl)phosphane?
The canonical SMILES for tert-butyl(ethylsulfanyl)phosphane is CCSPC(C)(C)C.
What is the InChIKey of tert-butyl(ethylsulfanyl)phosphane?
The InChIKey is DGZCNQLYBWZAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15PS/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3.
What are the key properties of tert-butyl(ethylsulfanyl)phosphane?
tert-butyl(ethylsulfanyl)phosphane has a molecular weight of 150.23 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(ethylsulfanyl)phosphane is sourced from PubChem (CID 16699435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).