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101832-10-4 | Ethanone, 2,2,2-trifluoro-1-(5-nitro-1H-indol-3-yl)-
CAS No: 101832-10-4 Catalog No: AG0005OD MDL No:MFCD01718619
Product Description
Catalog Number:
AG0005OD
Chemical Name:
Ethanone, 2,2,2-trifluoro-1-(5-nitro-1H-indol-3-yl)-
CAS Number:
101832-10-4
Molecular Formula:
C10H5F3N2O3
Molecular Weight:
258.1535
MDL Number:
MFCD01718619
IUPAC Name:
2,2,2-trifluoro-1-(5-nitro-1H-indol-3-yl)ethanone
InChI:
InChI=1S/C10H5F3N2O3/c11-10(12,13)9(16)7-4-14-8-2-1-5(15(17)18)3-6(7)8/h1-4,14H
InChI Key:
PUZBKXUISZMSFP-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1c[nH]c2c1cc(cc2)[N+](=O)[O-]
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.025g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.156g/mol
Monoisotopic Mass:
258.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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