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1159831-04-5 | Imidazo[1,2-a]pyridine-3-carboxylic acid, 8-bromo-
CAS No: 1159831-04-5 Catalog No: AG000HD9 MDL No:MFCD12401607
Product Description
Catalog Number:
AG000HD9
Chemical Name:
Imidazo[1,2-a]pyridine-3-carboxylic acid, 8-bromo-
CAS Number:
1159831-04-5
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
MDL Number:
MFCD12401607
IUPAC Name:
8-bromoimidazo[1,2-a]pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H5BrN2O2/c9-5-2-1-3-11-6(8(12)13)4-10-7(5)11/h1-4H,(H,12,13)
InChI Key:
IGHXXXOPUINBRQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2n1cccc2Br
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.953g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.044g/mol
Monoisotopic Mass:
239.953g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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