5-bromo-1-methylimidazole-2-carbaldehyde


Chemical Name: 5-bromo-1-methylimidazole-2-carbaldehyde
CAS Number: 79326-88-8
Product Number: AG005KDT(AGN-PC-0NK3TE)
Synonyms:
MDL No:
Molecular Formula: C5H5BrN2O
Molecular Weight: 189.0100

Identification/Properties


Properties
MP:
78-80°C
BP:
317°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
189.012g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
187.959g/mol
Monoisotopic Mass:
187.959g/mol
Topological Polar Surface Area:
34.9A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
120
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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