ethyl 5-bromo-2-methyl-1,3-oxazole-4-carboxylate


Chemical Name: ethyl 5-bromo-2-methyl-1,3-oxazole-4-carboxylate
CAS Number: 1260861-94-6
Product Number: AG000RGT(AGN-PC-0BL84Y)
Synonyms:
MDL No:
Molecular Formula: C7H8BrNO3
Molecular Weight: 234.0473

Identification/Properties


Computed Properties
Molecular Weight:
234.049g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
232.969g/mol
Monoisotopic Mass:
232.969g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
176
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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