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Home > Fluorides > 1260664-09-2
1260664-09-2 | 1H-Pyrrolo[3,2-b]pyridine, 2,3-dihydro-6-(trifluoroMethyl)-
CAS No: 1260664-09-2 Catalog No: AG000QZJ MDL No:
Product Description
Catalog Number:
AG000QZJ
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 2,3-dihydro-6-(trifluoroMethyl)-
CAS Number:
1260664-09-2
Molecular Formula:
C8H7F3N2
Molecular Weight:
188.1498
IUPAC Name:
6-(trifluoromethyl)-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C8H7F3N2/c9-8(10,11)5-3-7-6(13-4-5)1-2-12-7/h3-4,12H,1-2H2
InChI Key:
AYAVHBMDLNPDJL-UHFFFAOYSA-N
SMILES:
FC(c1cnc2c(c1)NCC2)(F)F
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.153g/mol
Monoisotopic Mass:
188.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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