methylsulfanylmethanone;yttrium

C2H3OSY- — CID 169173057

IUPACmethylsulfanylmethanone;yttrium
SMILESCS[C-]=O.[Y]
InChIInChI=1S/C2H3OS.Y/c1-4-2-3;/h1H3;/q-1;
InChIKeyCWZSZLDFQMPHQG-UHFFFAOYSA-N
MW164.02 g/mol
LogP0.41
Rot. Bonds1

About methylsulfanylmethanone;yttrium

methylsulfanylmethanone;yttrium (PubChem CID 169173057) has the molecular formula C2H3OSY- and a molecular weight of 164.02 g/mol. Its IUPAC name is methylsulfanylmethanone;yttrium.

Molecular Properties

Compound Namemethylsulfanylmethanone;yttrium
PubChem CID169173057
Molecular FormulaC2H3OSY-
Molecular Weight164.02 g/mol
Exact Mass163.90
IUPAC Namemethylsulfanylmethanone;yttrium
SMILESCS[C-]=O.[Y]
InChIInChI=1S/C2H3OS.Y/c1-4-2-3;/h1H3;/q-1;
InChIKeyCWZSZLDFQMPHQG-UHFFFAOYSA-N
XLogP0.41
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.02
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methylsulfanylmethanone;yttrium?
The IUPAC name of methylsulfanylmethanone;yttrium (CID 169173057) is methylsulfanylmethanone;yttrium.
What is the SMILES notation for methylsulfanylmethanone;yttrium?
The canonical SMILES for methylsulfanylmethanone;yttrium is CS[C-]=O.[Y].
What is the InChIKey of methylsulfanylmethanone;yttrium?
The InChIKey is CWZSZLDFQMPHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3OS.Y/c1-4-2-3;/h1H3;/q-1;.
What are the key properties of methylsulfanylmethanone;yttrium?
methylsulfanylmethanone;yttrium has a molecular weight of 164.02 g/mol, XLogP of 0.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfanylmethanone;yttrium is sourced from PubChem (CID 169173057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).