Molecule

ID:125812

General Information
Structure
MolImage
Molecular Formula
CH₅NO₃
Molecular Mass
79.0553
Exact Mass
79.02694303
Charge
0
InChI
InChI=1S/CH2O3.H3N/c2-1(3)4;/h(H2,2,3,4);1H3
InChIKey
ATRRKUHOCOJYRX-UHFFFAOYSA-N
Canonic Smiles
[O-]C(=O)O.[NH4+]
Isomeric Smiles
[O-]C(=O)O.[NH4+]
Calculated Properties
JChem
Acid pKa
6.0525417
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
0.142811
LogD (pH = 7.4)
-1.1138874
Log P
0.25005138
Molar Refractivity
20.3353
Polarizability
3.759794
Polar Surface Area
60.36
Rotatable Bonds
0
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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