Molecule

ID:95164

General Information

Structure

MolImage

Molecular Formula

C₃HClF₄

Molecular Mass

148.4866528

Exact Mass

147.97029059

Charge

0

InChI

InChI=1S/C3HClF4/c4-2(5)1-3(6,7)8/h1H

InChIKey

PNWJILFKWURCIR-UHFFFAOYSA-N

Canonic Smiles

F/C(=C/C(F)(F)F)/Cl

Isomeric Smiles

F/C(=C/C(F)(F)F)/Cl

Calculated Properties

JChem

H Acceptors

0

H Donor

0

LogD (pH = 5.5)

2.3246102

LogD (pH = 7.4)

2.3246102

Log P

2.3246102

Molar Refractivity

32.3464

Polarizability

7.7557583

Polar Surface Area

0.0

Rotatable Bonds

1

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity