methyl 2-(3-bromoquinolin-6-yl)acetate


Chemical Name: methyl 2-(3-bromoquinolin-6-yl)acetate
CAS Number: 1022091-89-9
Product Number: AG0006X5(AGN-PC-0C9VS6)
Synonyms:
MDL No:
Molecular Formula: C12H10BrNO2
Molecular Weight: 280.1173

Identification/Properties


Computed Properties
Molecular Weight:
280.121g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
278.989g/mol
Monoisotopic Mass:
278.989g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
259
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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