methane;sulfonylnickel

CH4NiO2S — CID 159225202

IUPACmethane;sulfonylnickel
SMILESC.O=S(=O)=[Ni]
InChIInChI=1S/CH4.Ni.O2S/c;;1-3-2/h1H4;;
InChIKeyITEXQWIHRXUKRL-UHFFFAOYSA-N
MW138.80 g/mol
LogP-0.04
Rot. Bonds

About methane;sulfonylnickel

methane;sulfonylnickel (PubChem CID 159225202) has the molecular formula CH4NiO2S and a molecular weight of 138.80 g/mol. Its IUPAC name is methane;sulfonylnickel.

Molecular Properties

Compound Namemethane;sulfonylnickel
PubChem CID159225202
Molecular FormulaCH4NiO2S
Molecular Weight138.80 g/mol
Exact Mass137.93
IUPAC Namemethane;sulfonylnickel
SMILESC.O=S(=O)=[Ni]
InChIInChI=1S/CH4.Ni.O2S/c;;1-3-2/h1H4;;
InChIKeyITEXQWIHRXUKRL-UHFFFAOYSA-N
XLogP-0.04
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.80
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of methane;sulfonylnickel?
The IUPAC name of methane;sulfonylnickel (CID 159225202) is methane;sulfonylnickel.
What is the SMILES notation for methane;sulfonylnickel?
The canonical SMILES for methane;sulfonylnickel is C.O=S(=O)=[Ni].
What is the InChIKey of methane;sulfonylnickel?
The InChIKey is ITEXQWIHRXUKRL-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.Ni.O2S/c;;1-3-2/h1H4;;.
What are the key properties of methane;sulfonylnickel?
methane;sulfonylnickel has a molecular weight of 138.80 g/mol, XLogP of -0.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;sulfonylnickel is sourced from PubChem (CID 159225202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).