Molecule

ID:109249

General Information
Structure
MolImage
Molecular Formula
C₂BeO₄
Molecular Mass
97.031182
Exact Mass
96.99184068
Charge
0
InChI
InChI=1S/C2H2O4.Be/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
InChIKey
XQZGLPVUHKSNBQ-UHFFFAOYSA-L
Canonic Smiles
O=C1O[Be]OC1=O
Isomeric Smiles
O=C1O[Be]OC1=O
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.3814
LogD (pH = 7.4)
1.3814
Log P
1.3814
Molar Refractivity
12.5834
Polarizability
7.019946
Polar Surface Area
52.6
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation