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1018828-72-2

1018828-72-2 | IMidazo[1,2-a]pyridine-2-carboxylic acid, 8-(trifluoroMethyl)-

CAS No: 1018828-72-2 Catalog No: AG0005TG MDL No:

Product Description

Catalog Number:
AG0005TG
Chemical Name:
IMidazo[1,2-a]pyridine-2-carboxylic acid, 8-(trifluoroMethyl)-
CAS Number:
1018828-72-2
Molecular Formula:
C9H5F3N2O2
Molecular Weight:
230.1434
IUPAC Name:
8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
InChI:
InChI=1S/C9H5F3N2O2/c10-9(11,12)5-2-1-3-14-4-6(8(15)16)13-7(5)14/h1-4H,(H,15,16)
InChI Key:
QRXSLIVFFDRFEB-UHFFFAOYSA-N
SMILES:
OC(=O)c1cn2c(n1)c(ccc2)C(F)(F)F

Properties

Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.146g/mol
Monoisotopic Mass:
230.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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