ethylsulfanylethane;yttrium

C4H8SY-2 — CID 164668417

IUPACethylsulfanylethane;yttrium
SMILES[CH2-]CSC[CH2-].[Y]
InChIInChI=1S/C4H8S.Y/c1-3-5-4-2;/h1-4H2;/q-2;
InChIKeyRRMUMLLGBJVNDL-UHFFFAOYSA-N
MW177.08 g/mol
LogP1.39
Rot. Bonds2

About ethylsulfanylethane;yttrium

ethylsulfanylethane;yttrium (PubChem CID 164668417) has the molecular formula C4H8SY-2 and a molecular weight of 177.08 g/mol. Its IUPAC name is ethylsulfanylethane;yttrium.

Molecular Properties

Compound Nameethylsulfanylethane;yttrium
PubChem CID164668417
Molecular FormulaC4H8SY-2
Molecular Weight177.08 g/mol
Exact Mass176.94
IUPAC Nameethylsulfanylethane;yttrium
SMILES[CH2-]CSC[CH2-].[Y]
InChIInChI=1S/C4H8S.Y/c1-3-5-4-2;/h1-4H2;/q-2;
InChIKeyRRMUMLLGBJVNDL-UHFFFAOYSA-N
XLogP1.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.08
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4-Dithiane
CID 10452
1,4-Thiatellurane
CID 71355891
1,4-Thiaselenane
CID 129698530
2,2,6,6-Tetradeuterio-1,4-dithiane
CID 12277169
Exomethylene 1,4-dithiane
CID 129653139
1-Methyl-1,4-dithian-1-ium
CID 5227399
1,4-Dithian-1-ium
CID 17822141
3,4,5,6-tetrahydro-2H-thiopyran-6-ide;yttrium
CID 59215191
1,4-Thiaborinane
CID 71363450
Copper;1,4-dithiane
CID 117951697
1-Sulfinyl-1,4-dithiane
CID 129666754
1,1-Dimethyl-1,4-dithiane
CID 130329490

Frequently Asked Questions

What is the IUPAC name of ethylsulfanylethane;yttrium?
The IUPAC name of ethylsulfanylethane;yttrium (CID 164668417) is ethylsulfanylethane;yttrium.
What is the SMILES notation for ethylsulfanylethane;yttrium?
The canonical SMILES for ethylsulfanylethane;yttrium is [CH2-]CSC[CH2-].[Y].
What is the InChIKey of ethylsulfanylethane;yttrium?
The InChIKey is RRMUMLLGBJVNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8S.Y/c1-3-5-4-2;/h1-4H2;/q-2;.
What are the key properties of ethylsulfanylethane;yttrium?
ethylsulfanylethane;yttrium has a molecular weight of 177.08 g/mol, XLogP of 1.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylsulfanylethane;yttrium is sourced from PubChem (CID 164668417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).