Home Halogens 1-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridine-3-carboxylic acid

1-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridine-3-carboxylic acid

CAS No.:
1781909-10-1
Catalog Number:
AG01DTDH
Molecular Formula:
C8H9BrN2O2
Molecular Weight:
245.0733
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Product Description
Catalog Number:
AG01DTDH
Chemical Name:
1-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridine-3-carboxylic acid
CAS Number:
1781909-10-1
Molecular Formula:
C8H9BrN2O2
Molecular Weight:
245.0733
MDL Number:
MFCD29079559
IUPAC Name:
1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H9BrN2O2/c9-6-5-3-1-2-4-11(5)7(10-6)8(12)13/h1-4H2,(H,12,13)
InChI Key:
GUWDASFJHMNMMP-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(c2n1CCCC2)Br
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.985g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.076g/mol
Monoisotopic Mass:
243.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties