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117391-20-5 | Acetamide, N-(2,3-dihydro-3-oxo-1H-inden-1-yl)-2,2,2-trifluoro-
CAS No: 117391-20-5 Catalog No: AG000E7Z MDL No:MFCD24842761
Product Description
Catalog Number:
AG000E7Z
Chemical Name:
Acetamide, N-(2,3-dihydro-3-oxo-1H-inden-1-yl)-2,2,2-trifluoro-
CAS Number:
117391-20-5
Molecular Formula:
C11H8F3NO2
Molecular Weight:
243.1819
MDL Number:
MFCD24842761
IUPAC Name:
2,2,2-trifluoro-N-(3-oxo-1,2-dihydroinden-1-yl)acetamide
InChI:
InChI=1S/C11H8F3NO2/c12-11(13,14)10(17)15-8-5-9(16)7-4-2-1-3-6(7)8/h1-4,8H,5H2,(H,15,17)
InChI Key:
JKTZEXJQDLSNPN-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)NC1CC(=O)c2c1cccc2
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.185g/mol
Monoisotopic Mass:
243.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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