Toluene diisocyanate manufacturer Knowledge Ethyl dibromofluoroacetate

Ethyl dibromofluoroacetate

Structural formula of ethyl dibromofluoroacetate

Structural formula

Business number 05T7
Molecular formula C4H5FBr2O
Molecular weight 263.89
label

Dibromofluoroacetic acid ethyl ester,

Pharmaceutical R&D

Numbering system

CAS number:565-53-7

MDL number:MFCD00042068

EINECS number:000-000-0

RTECS number:None

BRN number:1762048

PubChem ID:None

Physical property data

1. Physical property data


1. Boiling point:82.


2. Density1.894.

Toxicological data

None yet

Ecological data

None yet

Molecular structure data


5. Molecular property data:


1. Molar refractive index:37.94


2. Molar volume (m3/mol):129.9


3. Isotonic specific volume (90.2K): 324.9


4. Surface tension (dyne/cm): 39.1


5. Polarizability10-24 cm3):15.04

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 26.3

7. Number of heavy atoms: 9

8. Surface charge: 0

9. Complexity: 115

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 yet

Storage method

None yet

Synthesis method

None yet

Purpose

None yet

Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine Number of stereocenters of chemical bonds: 0

14. Number of stereocenters of uncertain chemical bonds: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

None yet

Synthesis method

None yet

Purpose

None yet

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