CID 59949730

C2H4O2Rf — CID 59949730

IUPAC—
SMILES[CH]OCO.[Rf]
InChIInChI=1S/C2H4O2.Rf/c1-4-2-3;/h1,3H,2H2;
InChIKeyCMIOKEQXFPIMAV-UHFFFAOYSA-N
MW327.05 g/mol
LogP-0.38
Rot. Bonds1

About CID 59949730

CID 59949730 (PubChem CID 59949730) has the molecular formula C2H4O2Rf and a molecular weight of 327.05 g/mol.

Molecular Properties

Compound NameCID 59949730
PubChem CID59949730
Molecular FormulaC2H4O2Rf
Molecular Weight327.05 g/mol
Exact Mass327.14
IUPAC Name—
SMILES[CH]OCO.[Rf]
InChIInChI=1S/C2H4O2.Rf/c1-4-2-3;/h1,3H,2H2;
InChIKeyCMIOKEQXFPIMAV-UHFFFAOYSA-N
XLogP-0.38
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.05
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 59949730?
The IUPAC name of CID 59949730 (CID 59949730) is not available.
What is the SMILES notation for CID 59949730?
The canonical SMILES for CID 59949730 is [CH]OCO.[Rf].
What is the InChIKey of CID 59949730?
The InChIKey is CMIOKEQXFPIMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.Rf/c1-4-2-3;/h1,3H,2H2;.
What are the key properties of CID 59949730?
CID 59949730 has a molecular weight of 327.05 g/mol, XLogP of -0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59949730 is sourced from PubChem (CID 59949730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).