anthranilic acid
Structural formula
| Business number | 0209 |
|---|---|
| Molecular formula | C8H7NO3 |
| Molecular weight | 165.15 |
| label |
o-carboxamide benzoic acid, 2-(Aminocarbonyl)benzoic acid, H2NC(O)C6H4CO2H |
Numbering system
CAS number:88-97-1
MDL number:MFCD00025476
EINECS number:201-871-1
RTECS number:None
BRN number:1868205
PubChem number:24879599
Physical property data
1. Properties: prismatic crystal.
2. Density (g/mL, 25/4℃): Undetermined
3. Relative vapor density (g/mL, air=1): Undetermined
4. Melting point (ºC): 148～149
5. Boiling point (ºC, normal pressure): Undetermined
6. Boiling point (ºC, 5.2kPa): Undetermined
7. Refractive index: Undetermined
8. Flash point (ºC): Undetermined
9. Specific rotation (º): Undetermined Determined
10. Autoignition point or ignition temperature (ºC): Not determined
11. Vapor pressure (kPa, 25ºC): Not determined
12. Saturated vapor pressure (kPa, 60ºC): Undetermined
13. Heat of combustion (KJ/mol): Undetermined
14. Critical temperature (ºC): Undetermined
15. Critical pressure (KPa): Undetermined
16. Log value of oil-water (octanol/water) partition coefficient: Undetermined
17. Explosion upper limit ( %, V/V): Undetermined
18. Lower explosion limit (%, V/V): Undetermined
19. Solubility: When heated to 155°C, it becomes xylenedimethyl Amide. Slightly soluble in ethanol and hot water, slightly soluble in ether and benzene, insoluble in petroleum.
Toxicological data
None
Ecological data
None
Molecular structure data
1. Molar refractive index: 42.11
2. Molar volume (cm3/mol): 120.6
3. Isotonic specific volume (90.2K ): 343.8
4. Surface tension (dyne/cm): 65.9
5. Polarizability (10-24cm3): 16.69
Compute chemical data
1. Hydrophobic parameter calculation reference value (XlogP): 0.1
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond acceptors: 3
4. Can be rotatedNumber of bonds: 2
5. Number of tautomers: 2
6. Topological molecular polar surface area (TPSA): 80.4
7. Number of heavy atoms: 12
8, Surface charge: 0
9, Complexity: 203
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
Storage method
This product should be kept sealed.
Synthesis method
None
Purpose
Organic Synthesis.
