Structural formula
| Business number | 018L |
|---|---|
| Molecular formula | C15H12N2O2 |
| Molecular weight | 252.27 |
| label |
Phenytoin, 5,5-Diphenyl-2,4-imidazolidinedione, Phenytoin |
Numbering system
CAS number:57-41-0
MDL number:MFCD00005264
EINECS number:200-328-6
RTECS number:MU1050000
BRN number:384532
PubChem number:24278370
Physical property data
None
Toxicological data
None
Ecological data
None
Molecular structure data
1. Molar refractive index: 69.58
2. Molar volume (cm3/mol): 200.5
3. Isotonic specific volume (90.2K ): 531.3
4. Surface tension (dyne/cm): 49.2
5. Polarizability (10-24cm3): 27.58
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: 2
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 5
6. Topological molecule polar surface area 58.2
7. Number of heavy atoms: 19
8. Surface charge: 0
9. Complexity: 350
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 sealed and stored away from light.
Synthesis method
None
Purpose
Organic Synthesis. Antiepileptic, anticonvulsant drugs.
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