4-Amino-8-bromoquinoline-3-carboxylic acid ethyl ester


Chemical Name: 4-Amino-8-bromoquinoline-3-carboxylic acid ethyl ester
CAS Number: 1242260-89-4
Product Number: AG009W0M(AGN-009VV2)
Synonyms:
MDL No:
Molecular Formula: C12H11BrN2O2
Molecular Weight: 295.1319

Identification/Properties


Computed Properties
Molecular Weight:
295.136g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
294g/mol
Monoisotopic Mass:
294g/mol
Topological Polar Surface Area:
65.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
288
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

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NMR Spectrum


Other Analytical Data


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