2-Fluoradenosine
Structural formula
| Business number | 03X1 |
|---|---|
| Molecular formula | C10H12FN5O4 |
| Molecular weight | 285.23 |
| label |
2-fluoradenosine, 6-Amino-2-fluoro-9-beta-d-ribofuranosyl-purin |
Numbering system
CAS number:146-78-1
MDL number:MFCD00866394
EINECS number:None
RTECS number:AU7386000
BRN number:None
PubChem number:24884201
Physical property data
1. Physical property data:
1. Characteristics: White powder
2. Melting point (ºC): 240ºC
Toxicological data
2. Toxicological data:
1, acute toxicity:Mouse abdominal cavityLD50：27040 ug/kg；
Mice are reported LD10: 1000 ug/kg.
Ecological data
3. Ecological data:
Other harmful Effect: This substance may be harmful to the environment, and special attention should be paid to water bodies.
Molecular structure data
5. Molecular property data: 1. Molar refractive index:59.82 2. Molar volume (m3/mol):131.0 3. Isotonic specific volume (90.2K):412.9 4. Surface tension (dyne/cm):98.5 5. Polarizability(10-24cm3）：23.71
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 4
3. Number of hydrogen bond acceptors: 9
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 3
6. Topological molecule polar surface area 140
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 367
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 4
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
Stable under normal temperature and pressure.
Storage method
Save in a dry and cool place.
Synthesis method
None
Purpose
None
ng=EN-US style=”FONT-SIZE: 9pt; FONT-FAMILY: ‘Arial’,’sans-serif'”>412.9
4. Surface tension (dyne/cm):98.5
5. Polarizability(10-24cm3）：23.71
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 4
3. Number of hydrogen bond acceptors: 9
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 3
6. Topological molecule polar surface area 140
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 367
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 4
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
Stable under normal temperature and pressure.
Storage method
Save in a dry and cool place.
Synthesis method
None
Purpose
None
