5-Bromo-2′-deoxyuridine 5-Bromo-2′-deoxyuridine
Structural formula
| Business number | 01A6 |
|---|---|
| Molecular formula | C9H11N2O5Br |
| Molecular weight | 307.1 |
| label |
5-BrdU, 5-Bromo-1-(2-deoxy-β-D-ribofuranosyl)uracil, 5-Bromouracil deoxyriboside, BUdR, 5-bromo-2′-deoxyuridine; deoxybromouridine; bromouridine deoxynucleoside; 1-(2-deoxy-β-D-ribofuranosyl)-5-bromouracil, antineoplastic drugs |
Numbering system
CAS number:59-14-3
MDL number:MFCD00006529
EINECS number:200-415-9
RTECS number:YU7350000
BRN number:30395
PubChem number:24278270
Physical property data
1. Properties: off-white powder.
2. Density (g/mL, 25/4℃): Undetermined
3. Relative vapor density (g/mL, air=1): Undetermined
4. Melting point (ºC): 187～189
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: Hardly soluble in water and methanol, almost insoluble in chloroform and benzene, easily soluble in sodium hydroxide solution.
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
1. Molar refractive index: 58.92
2. Molar volume (cm3/mol): 161.1
3. Isotonic specific volume (90.2K): 481.3
4. Surface tension (dyne/cm): 79.5
5. Polarizability (10-24cm3): 23.35
Compute chemical data
1. Hydrophobic parameter calculation reference��(XlogP): None
2. Number of hydrogen bond donors: 3
3. Number of hydrogen bond acceptors: 5
4. Rotable Number of chemical bonds: 2
5. Number of tautomers: 3
6. Topological molecule polar surface area 99.1
7. Number of heavy atoms: 17
8. Surface charge: 0
9. Complexity: 386
10. Number of isotope atoms: 0
11. Determine Number of atomic stereocenters: 3
12. Uncertain number of atomic stereocenters: 0
13. Determined number of chemical bond stereocenters: 0
14 .The number of uncertain chemical bond stereocenters: 0
15. The number of covalent bond units: 1
Properties and stability
This product is a thymidine metabolism antagonist that can inhibit the proliferation of adenovirus. It is generally used as a radiosensitizer during cell proliferation. It is incorporated into DAN instead of thymine to increase the sensitivity of cells to radioactivity and ultraviolet light.
Storage method
This product should be sealed with argon and stored at 4℃.
Synthesis method
None yet
Purpose
1. Biochemical research.
2.Radiosensitizer for brain tumors and head and neck tumors to improve the effect of radiotherapy. Combination with anti-metabolite agents can also improve efficacy.
