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1454847-98-3 | 2-Pyridinamine, 3-[(1R)-1-(5-fluoro-2-iodophenyl)ethoxy]-
CAS No: 1454847-98-3 Catalog No: AG001D3E MDL No:
Product Description
Catalog Number:
AG001D3E
Chemical Name:
2-Pyridinamine, 3-[(1R)-1-(5-fluoro-2-iodophenyl)ethoxy]-
CAS Number:
1454847-98-3
Molecular Formula:
C13H12FIN2O
Molecular Weight:
358.1501
IUPAC Name:
3-[(1R)-1-(5-fluoro-2-iodophenyl)ethoxy]pyridin-2-amine
InChI:
InChI=1S/C13H12FIN2O/c1-8(10-7-9(14)4-5-11(10)15)18-12-3-2-6-17-13(12)16/h2-8H,1H3,(H2,16,17)/t8-/m1/s1
InChI Key:
OYOAYUWCUQLRHK-MRVPVSSYSA-N
SMILES:
Fc1ccc(c(c1)[C@H](Oc1cccnc1N)C)I
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
357.998g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.155g/mol
Monoisotopic Mass:
357.998g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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