2-Propenoic acid, 3-(5-bromo-2-methoxyphenyl)-


Chemical Name: 2-Propenoic acid, 3-(5-bromo-2-methoxyphenyl)-
CAS Number: 40803-53-0
Product Number: AG003MHI(AGN-PC-0JUSIB)
Synonyms:
MDL No:
Molecular Formula: C10H9BrO3
Molecular Weight: 257.0807

Identification/Properties


Properties
MP:
224-227 °C(lit.)
BP:
381.5°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
257.083g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
255.974g/mol
Monoisotopic Mass:
255.974g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
227
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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