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Home > Fluorides > 1190311-33-1
1190311-33-1 | 2H-Pyrrolo[3,2-b]pyridin-2-one, 1,3-dihydro-7-(trifluoromethyl)-
CAS No: 1190311-33-1 Catalog No: AG000HHG MDL No:
Product Description
Catalog Number:
AG000HHG
Chemical Name:
2H-Pyrrolo[3,2-b]pyridin-2-one, 1,3-dihydro-7-(trifluoromethyl)-
CAS Number:
1190311-33-1
Molecular Formula:
C8H5F3N2O
Molecular Weight:
202.1333
IUPAC Name:
7-(trifluoromethyl)-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
InChI:
InChI=1S/C8H5F3N2O/c9-8(10,11)4-1-2-12-5-3-6(14)13-7(4)5/h1-2H,3H2,(H,13,14)
InChI Key:
DASFQZIWXPZLAZ-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1)c(ccn2)C(F)(F)F
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.136g/mol
Monoisotopic Mass:
202.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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