3-Bromoquinoline-7-carboxylic acid


Chemical Name: 3-Bromoquinoline-7-carboxylic acid
CAS Number: 1344046-13-4
Product Number: AG009DE0(AGN-PC-0WAHNK)
Synonyms:
MDL No:
Molecular Formula: C10H6BrNO2
Molecular Weight: 252.0641

Identification/Properties


Computed Properties
Molecular Weight:
252.067g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
250.958g/mol
Monoisotopic Mass:
250.958g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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