Methyl 5-bromo-4-methoxy-2-methylbenzoate


Chemical Name: Methyl 5-bromo-4-methoxy-2-methylbenzoate
CAS Number: 1131587-94-4
Product Number: AG003RXG(AGN-PC-0WAM0J)
Synonyms:
MDL No: MFCD11112987
Molecular Formula: C10H11BrO3
Molecular Weight: 259.0965

Identification/Properties


Properties
BP:
313.7±37.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
259.099g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
257.989g/mol
Monoisotopic Mass:
257.989g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
208
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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