fluoroform;pyrrolidine-2,5-dione

C6H7F6NO2 — CID 158532811

IUPACfluoroform;pyrrolidine-2,5-dione
SMILESFC(F)F.FC(F)F.O=C1CCC(=O)N1
InChIInChI=1S/C4H5NO2.2CHF3/c6-3-1-2-4(7)5-3;2*2-1(3)4/h1-2H2,(H,5,6,7);2*1H
InChIKeyHNOSIPUNELRPFG-UHFFFAOYSA-N
MW239.12 g/mol
LogP1.78
Rot. Bonds

About fluoroform;pyrrolidine-2,5-dione

fluoroform;pyrrolidine-2,5-dione (PubChem CID 158532811) has the molecular formula C6H7F6NO2 and a molecular weight of 239.12 g/mol. Its IUPAC name is fluoroform;pyrrolidine-2,5-dione.

Molecular Properties

Compound Namefluoroform;pyrrolidine-2,5-dione
PubChem CID158532811
Molecular FormulaC6H7F6NO2
Molecular Weight239.12 g/mol
Exact Mass239.04
IUPAC Namefluoroform;pyrrolidine-2,5-dione
SMILESFC(F)F.FC(F)F.O=C1CCC(=O)N1
InChIInChI=1S/C4H5NO2.2CHF3/c6-3-1-2-4(7)5-3;2*2-1(3)4/h1-2H2,(H,5,6,7);2*1H
InChIKeyHNOSIPUNELRPFG-UHFFFAOYSA-N
XLogP1.78
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.12
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoroform;pyrrolidine-2,5-dione?
The IUPAC name of fluoroform;pyrrolidine-2,5-dione (CID 158532811) is fluoroform;pyrrolidine-2,5-dione.
What is the SMILES notation for fluoroform;pyrrolidine-2,5-dione?
The canonical SMILES for fluoroform;pyrrolidine-2,5-dione is FC(F)F.FC(F)F.O=C1CCC(=O)N1.
What is the InChIKey of fluoroform;pyrrolidine-2,5-dione?
The InChIKey is HNOSIPUNELRPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO2.2CHF3/c6-3-1-2-4(7)5-3;2*2-1(3)4/h1-2H2,(H,5,6,7);2*1H.
What are the key properties of fluoroform;pyrrolidine-2,5-dione?
fluoroform;pyrrolidine-2,5-dione has a molecular weight of 239.12 g/mol, XLogP of 1.78, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroform;pyrrolidine-2,5-dione is sourced from PubChem (CID 158532811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).