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Home > Bromides > 1313410-86-4
1313410-86-4 | Imidazo[1,2-a]pyridine-3-carboxylic acid, 7-bromo-, methyl ester
CAS No: 1313410-86-4 Catalog No: AG000VYU MDL No:
Product Description
Catalog Number:
AG000VYU
Chemical Name:
Imidazo[1,2-a]pyridine-3-carboxylic acid, 7-bromo-, methyl ester
CAS Number:
1313410-86-4
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
IUPAC Name:
methyl 7-bromoimidazo[1,2-a]pyridine-3-carboxylate
InChI:
InChI=1S/C9H7BrN2O2/c1-14-9(13)7-5-11-8-4-6(10)2-3-12(7)8/h2-5H,1H3
InChI Key:
FITANCORDURZOD-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc2n1ccc(c2)Br
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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