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209971-50-6 | Imidazo[1,2-a]pyridine-6-carboxylic acid, 2-[(2,2,2-trifluoroacetyl)amino]-, methyl ester
CAS No: 209971-50-6 Catalog No: AG002KHS MDL No:MFCD04114697
Product Description
Catalog Number:
AG002KHS
Chemical Name:
Imidazo[1,2-a]pyridine-6-carboxylic acid, 2-[(2,2,2-trifluoroacetyl)amino]-, methyl ester
CAS Number:
209971-50-6
Molecular Formula:
C11H8F3N3O3
Molecular Weight:
287.1947
MDL Number:
MFCD04114697
IUPAC Name:
methyl 2-[(2,2,2-trifluoroacetyl)amino]imidazo[1,2-a]pyridine-6-carboxylate
InChI:
InChI=1S/C11H8F3N3O3/c1-20-9(18)6-2-3-8-15-7(5-17(8)4-6)16-10(19)11(12,13)14/h2-5H,1H3,(H,16,19)
InChI Key:
LHSKONMZXYISOV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2n(c1)cc(n2)NC(=O)C(F)(F)F
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.052g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.198g/mol
Monoisotopic Mass:
287.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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