Molecule

ID:109439

General Information
Structure
MolImage
Molecular Formula
C₆H₇AsO₃
Molecular Mass
202.03958
Exact Mass
201.96111508
Charge
0
InChI
InChI=1S/C6H7AsO3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H,(H2,8,9,10)
InChIKey
LVKZSFMYNWRPJX-UHFFFAOYSA-N
Canonic Smiles
O[As](=O)(c1ccccc1)O
Isomeric Smiles
O[As](=O)(O)c1ccccc1
Calculated Properties
JChem
LogD (pH = 7.4)
-1.34
LogD (pH = 5.5)
-0.91
Log P
0.93
Rotatable Bonds
1
H Donor
2
H Acceptors
3
Lipinski's Rule of Five
true
Acid pKa
3.46
Polar Surface Area
57.53
Polarizability
14.77
Molar Refractivity
32.05
LOG S
-0.56
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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