Molecule

ID:77209

General Information
Structure
MolImage
Molecular Formula
C₂H₃Cl₂NO
Molecular Mass
127.95732
Exact Mass
126.95916908
Charge
0
InChI
InChI=1S/C2H3Cl2NO/c3-1(4)2(5)6/h1H,(H2,5,6)
InChIKey
WCGGWVOVFQNRRS-UHFFFAOYSA-N
Canonic Smiles
ClC(C(=O)N)Cl
Isomeric Smiles
ClC(C(=O)N)Cl
Calculated Properties
JChem
Acid pKa
9.917648
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
0.25125483
LogD (pH = 7.4)
0.25241187
Log P
0.25124
Molar Refractivity
24.4417
Polarizability
9.565123
Polar Surface Area
43.09
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
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