1-Bromo-2,2-dimethoxypropane 1-Bromo-2,2-dimethoxypropane
Structural formula
| Business number | 03K3 |
|---|---|
| Molecular formula | C5H11BrO2 |
| Molecular weight | 183.05 |
| label |
aliphatic compounds |
Numbering system
CAS number:126-38-5
MDL number:MFCD00000208
EINECS number:204-784-7
RTECS number:None
BRN number:None
PubChem number:24852531
Physical property data
None
Toxicological data
None
Ecological data
None
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 36.40
2. Molar volume (m3/mol）：137.0
3. Isotonic specific volume (90.2K): 317.6
4. Surface Tension (dyne/cm):28.8
5. Polarizability（10-24cm3):104.43
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 1
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 3
5. Number of tautomers: none
6. Topological molecule polar surface area 18.5
7. Number of heavy atoms: 8
8. Surface charge: 0
9. Complexity: 61.4
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
None
Synthesis method
None
Purpose
None