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1135283-39-4 | Imidazo[1,2-a]pyridine-2-carboxylic acid, 8-iodo-6-(trifluoromethyl)-, ethyl ester
CAS No: 1135283-39-4 Catalog No: AG0008WY MDL No:MFCD11841000
Product Description
Catalog Number:
AG0008WY
Chemical Name:
Imidazo[1,2-a]pyridine-2-carboxylic acid, 8-iodo-6-(trifluoromethyl)-, ethyl ester
CAS Number:
1135283-39-4
Molecular Formula:
C11H8F3IN2O2
Molecular Weight:
384.0931
MDL Number:
MFCD11841000
IUPAC Name:
ethyl 8-iodo-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
InChI:
InChI=1S/C11H8F3IN2O2/c1-2-19-10(18)8-5-17-4-6(11(12,13)14)3-7(15)9(17)16-8/h3-5H,2H2,1H3
InChI Key:
DCYJMANQARCUIZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc2n(c1)cc(cc2I)C(F)(F)F
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.958g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.097g/mol
Monoisotopic Mass:
383.958g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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