europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone

C7H4EuF3O2S- — CID 175297311

IUPACeuropium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone
SMILESO=C(c1cccs1)C(F)(F)F.[CH-]=O.[Eu]
InChIInChI=1S/C6H3F3OS.CHO.Eu/c7-6(8,9)5(10)4-2-1-3-11-4;1-2;/h1-3H;1H;/q;-1;
InChIKeyZRVPOWOJOXYQQE-UHFFFAOYSA-N
MW361.13 g/mol
LogP2.22
Rot. Bonds1

About europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone

europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone (PubChem CID 175297311) has the molecular formula C7H4EuF3O2S- and a molecular weight of 361.13 g/mol. Its IUPAC name is europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone.

Molecular Properties

Compound Nameeuropium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone
PubChem CID175297311
Molecular FormulaC7H4EuF3O2S-
Molecular Weight361.13 g/mol
Exact Mass361.91
IUPAC Nameeuropium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone
SMILESO=C(c1cccs1)C(F)(F)F.[CH-]=O.[Eu]
InChIInChI=1S/C6H3F3OS.CHO.Eu/c7-6(8,9)5(10)4-2-1-3-11-4;1-2;/h1-3H;1H;/q;-1;
InChIKeyZRVPOWOJOXYQQE-UHFFFAOYSA-N
XLogP2.22
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.13
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone?
The IUPAC name of europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone (CID 175297311) is europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone.
What is the SMILES notation for europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone?
The canonical SMILES for europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone is O=C(c1cccs1)C(F)(F)F.[CH-]=O.[Eu].
What is the InChIKey of europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone?
The InChIKey is ZRVPOWOJOXYQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3OS.CHO.Eu/c7-6(8,9)5(10)4-2-1-3-11-4;1-2;/h1-3H;1H;/q;-1;.
What are the key properties of europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone?
europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone has a molecular weight of 361.13 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for europium;methanone;2,2,2-trifluoro-1-thiophen-2-ylethanone is sourced from PubChem (CID 175297311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).