Molecule

ID:94889

General Information

Structure

MolImage

Molecular Formula

CClFO

Molecular Mass

82.4615032

Exact Mass

81.96217052

Charge

0

InChI

InChI=1S/CClFO/c2-1(3)4

InChIKey

OXVVNXMNLYYMOL-UHFFFAOYSA-N

Canonic Smiles

FC(=O)Cl

Isomeric Smiles

FC(=O)Cl

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

1.0291214

LogD (pH = 7.4)

1.0291214

Log P

1.0291214

Molar Refractivity

12.5802

Polarizability

4.7088566

Polar Surface Area

17.07

Rotatable Bonds

0

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

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Molecular Spectra

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Molecule Details

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References

Bioactivity