CID 23053638

H2ArF3NO — CID 23053638

IUPAC—
SMILESFN(F)F.O.[Ar]
InChIInChI=1S/Ar.F3N.H2O/c;1-4(2)3;/h;;1H2
InChIKeyNLGSDYYQAXXAJB-UHFFFAOYSA-N
MW128.96 g/mol
LogP0.12
Rot. Bonds

About CID 23053638

CID 23053638 (PubChem CID 23053638) has the molecular formula H2ArF3NO and a molecular weight of 128.96 g/mol.

Molecular Properties

Compound NameCID 23053638
PubChem CID23053638
Molecular FormulaH2ArF3NO
Molecular Weight128.96 g/mol
Exact Mass128.97
IUPAC Name—
SMILESFN(F)F.O.[Ar]
InChIInChI=1S/Ar.F3N.H2O/c;1-4(2)3;/h;;1H2
InChIKeyNLGSDYYQAXXAJB-UHFFFAOYSA-N
XLogP0.12
TPSA34.74 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.96
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 23053638?
The IUPAC name of CID 23053638 (CID 23053638) is not available.
What is the SMILES notation for CID 23053638?
The canonical SMILES for CID 23053638 is FN(F)F.O.[Ar].
What is the InChIKey of CID 23053638?
The InChIKey is NLGSDYYQAXXAJB-UHFFFAOYSA-N. The full InChI is InChI=1S/Ar.F3N.H2O/c;1-4(2)3;/h;;1H2.
What are the key properties of CID 23053638?
CID 23053638 has a molecular weight of 128.96 g/mol, XLogP of 0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23053638 is sourced from PubChem (CID 23053638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).