2-chloroadenosine
Structural formula
| Business number | 03X0 |
|---|---|
| Molecular formula | C10H12ClN5O4 |
| Molecular weight | 301.69 |
| label |
2-Chloroadenine nucleoside, 6-Amino-2-chloropurine riboside |
Numbering system
CAS number:146-77-0
MDL number:MFCD00005734
EINECS number:205-678-3
RTECS number:AU7357550
BRN number:None
PubChem number:24277688
Physical property data
1. Physical property data:
1. Appearance: white to white hygroscopic powder.
2. Melting point 145 ～ 150℃.
Toxicological data
2. Toxicological data:
1, acute toxicity: mice oral LD: >100 mg/kg ;
Mouse intravenous LDLo: 50 mg/kg.
2. Reproductive toxicity: mouse abdominal cavity TDLo: 603 ug/kg
Ecological data
3. Ecological data:
Usually for Water is not hazardous and materials should not be discharged into the surrounding environment without government permission.
Molecular structure data
5. Molecular property data: 1. Molar refractive index:64.55 2. Molar volume (m3/mol):137.4 3. Isotonic specific volume (90.2K):441.6 4. Surface tension (dyne/cm):106.5 5. Polarizability(10-24cm3）：25.59
Compute chemical data
4. Calculated chemical data:
1. Hydrophobic parameters Calculate reference value (XlogP）：-0.1
2. Hydrogen Bonding Number of donors: 4
3. Hydrogen Bonding Number of receptors: 8
4. Number of rotatable chemical bonds ：2
5. Topological molecules Polar surface area (TPSA）：140
6. Heavy atoms Quantity: 20
7. Surface charge ：0
8. Complexity ：367
9. Isotope atomic number:0
10. Determine the number of atomic stereocenters:0
11. Uncertain number of atomic stereocenters:4
12. Determine the number of stereocenters of chemical bonds:0
13. Uncertain number of chemical bond stereocenters:0
14. 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
FAMILY: Arial; mso-fareast-font-family: Arial”>10. Determine the number of atomic stereocenters:0
11. Uncertain number of atomic stereocenters:4
12. Determine the number of stereocenters of chemical bonds:0
13. Uncertain number of chemical bond stereocenters:0
14. 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
