2,3-benzofurandicarboxylic acid
structural formula
| business number | 03n8 |
|---|---|
| molecular formula | c10h6o5 |
| molecular weight | 206.15 |
| label |
benzene[b]furan-2,3-dicarboxylic acid, 1-benzofuran-2,3-dicarboxylic acid, aromatic compounds |
numbering system
cas number:131-76-0
mdl number:mfcd05863264
einecs number:none
rtecs number:none
brn number:none
pubchem number:24883220
physical property data
none yet
toxicological data
none yet
ecological data
none yet
molecular structure data
5. molecular property data:
1, moore refractive index: 50.25
2、 molar volume (m3/mol):131.4
3、 isotonic specific volume (90.2k) ：389.3
4, surface tension (dyne/cm):77.0
5、 polarizability (10-24cm3):19.92
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 1.7
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 5
4. number of rotatable chemical bonds: 2
5. number of tautomers: none
6. topological molecule polar surface area 87.7
7. number of heavy atoms: 15
8. surface charge: 0
9. complexity: 288
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 0
12. uncertain number of atomic stereocenters: 0
13. determine the number of chemical bond stereocenters: 0
14. number of uncertain chemical bond stereocenters: 0
15. number of covalent bond units: 1
properties and stability
none yet
storage method
none yet
synthesis method
none yet
purpose
none yet
mily: arial; mso-font-kerning: 0pt; mso-ascii-font-family: arial; mso-hansi-font-family: arial”>):19.92
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 1.7
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 5
4. number of rotatable chemical bonds: 2
5. number of tautomers: none
6. topological molecule polar surface area 87.7
7. number of heavy atoms: 15
8. surface charge: 0
9. complexity: 288
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 0
12. uncertain number of atomic stereocenters: 0
13. determine the number of chemical bond stereocenters: 0
14. number of uncertain chemical bond stereocenters: 0
15. number of covalent bond units: 1
properties and stability
none yet
storage method
none yet
synthesis method
none yet
purpose
none yet
