1-bromo-2,2-dimethoxypropane 1-bromo-2,2-dimethoxypropane

structural formula

• numbering system
• physical property data
• toxicological data
• ecological data
• molecular structure data
• computing chemical data
• more
  • properties and stability
  • storage method
  • synthesis method
  • purpose

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