dimethyl(methylsulfonylmethyl)phosphane

C4H11O2PS — CID 155634072

IUPACdimethyl(methylsulfonylmethyl)phosphane
SMILESCP(C)CS(C)(=O)=O
InChIInChI=1S/C4H11O2PS/c1-7(2)4-8(3,5)6/h4H2,1-3H3
InChIKeyYDELOFNQANLADC-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.73
Rot. Bonds2

About dimethyl(methylsulfonylmethyl)phosphane

dimethyl(methylsulfonylmethyl)phosphane (PubChem CID 155634072) has the molecular formula C4H11O2PS and a molecular weight of 154.17 g/mol. Its IUPAC name is dimethyl(methylsulfonylmethyl)phosphane.

Molecular Properties

Compound Namedimethyl(methylsulfonylmethyl)phosphane
PubChem CID155634072
Molecular FormulaC4H11O2PS
Molecular Weight154.17 g/mol
Exact Mass154.02
IUPAC Namedimethyl(methylsulfonylmethyl)phosphane
SMILESCP(C)CS(C)(=O)=O
InChIInChI=1S/C4H11O2PS/c1-7(2)4-8(3,5)6/h4H2,1-3H3
InChIKeyYDELOFNQANLADC-UHFFFAOYSA-N
XLogP0.73
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 169428164
CID 169428164
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CID 59060153
azane;2-methyl-1-methylsulfonylpropane;hydrochloride
CID 87536413
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3-methyl-1-methylsulfonylbutane
CID 20712453

Frequently Asked Questions

What is the IUPAC name of dimethyl(methylsulfonylmethyl)phosphane?
The IUPAC name of dimethyl(methylsulfonylmethyl)phosphane (CID 155634072) is dimethyl(methylsulfonylmethyl)phosphane.
What is the SMILES notation for dimethyl(methylsulfonylmethyl)phosphane?
The canonical SMILES for dimethyl(methylsulfonylmethyl)phosphane is CP(C)CS(C)(=O)=O.
What is the InChIKey of dimethyl(methylsulfonylmethyl)phosphane?
The InChIKey is YDELOFNQANLADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O2PS/c1-7(2)4-8(3,5)6/h4H2,1-3H3.
What are the key properties of dimethyl(methylsulfonylmethyl)phosphane?
dimethyl(methylsulfonylmethyl)phosphane has a molecular weight of 154.17 g/mol, XLogP of 0.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(methylsulfonylmethyl)phosphane is sourced from PubChem (CID 155634072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).