Structural formula
Business number | 01BX |
---|---|
Molecular formula | C15H15NO2 |
Molecular weight | 241.29 |
label |
N-(2,3-xylyl)-2-aminobenzoic acid, 2-[(2,3-Dimethylphenyl)amino]benzoic acid |
Numbering system
CAS number:61-68-7
MDL number:MFCD00051721
EINECS number:200-513-1
RTECS number:CB4550000
BRN number:None
PubChem number:24896815
Physical property data
None yet
Toxicological data
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Ecological data
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Molecular structure data
5. Molecular property data:
1. Molar refractive index: 72.20
2. Molar Volume (m3/mol):200.5
3. Isotonic specific volume (90.2K ): 538.0
4. Surface Tension (dyne/cm):51.7
5. Polarizability(10-24cm3): 28.62
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 3
5. Number of tautomers: 4
6. Topological molecule polar surface area 49.3
7. Number of heavy atoms: 18
8. Surface charge: 0
9. Complexity: 292
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
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Synthesis method
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Purpose
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