Methyl 2,4-dibromobutyrate


Chemical Name: Methyl 2,4-dibromobutyrate
CAS Number: 29547-04-4
Product Number: AG002YPU(AGN-PC-0JPFF0)
Synonyms:
MDL No: MFCD00130152
Molecular Formula: C5H8Br2O2
Molecular Weight: 259.9238

Identification/Properties


Computed Properties
Molecular Weight:
259.925g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
259.887g/mol
Monoisotopic Mass:
257.889g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
95
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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