CID 175728654

C2H3FLiO — CID 175728654

IUPAC—
SMILESC=COF.[Li]
InChIInChI=1S/C2H3FO.Li/c1-2-4-3;/h2H,1H2;
InChIKeyPIWFUUBAVAFQBM-UHFFFAOYSA-N
MW68.98 g/mol
LogP0.65
Rot. Bonds1

About CID 175728654

CID 175728654 (PubChem CID 175728654) has the molecular formula C2H3FLiO and a molecular weight of 68.98 g/mol.

Molecular Properties

Compound NameCID 175728654
PubChem CID175728654
Molecular FormulaC2H3FLiO
Molecular Weight68.98 g/mol
Exact Mass69.03
IUPAC Name—
SMILESC=COF.[Li]
InChIInChI=1S/C2H3FO.Li/c1-2-4-3;/h2H,1H2;
InChIKeyPIWFUUBAVAFQBM-UHFFFAOYSA-N
XLogP0.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50068.98
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 175728654?
The IUPAC name of CID 175728654 (CID 175728654) is not available.
What is the SMILES notation for CID 175728654?
The canonical SMILES for CID 175728654 is C=COF.[Li].
What is the InChIKey of CID 175728654?
The InChIKey is PIWFUUBAVAFQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3FO.Li/c1-2-4-3;/h2H,1H2;.
What are the key properties of CID 175728654?
CID 175728654 has a molecular weight of 68.98 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175728654 is sourced from PubChem (CID 175728654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).