3-bromo-5-(bromomethyl)-1,2,4-oxadiazole


Chemical Name: 3-bromo-5-(bromomethyl)-1,2,4-oxadiazole
CAS Number: 121562-13-8
Product Number: AG0015AM(AGN-PC-03DMXF)
Synonyms:
MDL No:
Molecular Formula: C3H2Br2N2O
Molecular Weight: 241.8688

Identification/Properties


Computed Properties
Molecular Weight:
241.87g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
241.851g/mol
Monoisotopic Mass:
239.853g/mol
Topological Polar Surface Area:
38.9A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
81.7
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:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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