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25080-83-5 | Acetamide, 2,2,2-trifluoro-N-(3-nitrophenyl)-
CAS No: 25080-83-5 Catalog No: AG002QFB MDL No:MFCD00452601
Product Description
Catalog Number:
AG002QFB
Chemical Name:
Acetamide, 2,2,2-trifluoro-N-(3-nitrophenyl)-
CAS Number:
25080-83-5
Molecular Formula:
C8H5F3N2O3
Molecular Weight:
234.1321
MDL Number:
MFCD00452601
IUPAC Name:
2,2,2-trifluoro-N-(3-nitrophenyl)acetamide
InChI:
InChI=1S/C8H5F3N2O3/c9-8(10,11)7(14)12-5-2-1-3-6(4-5)13(15)16/h1-4H,(H,12,14)
InChI Key:
ODXWGMFPJCIUCW-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)Nc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.134g/mol
Monoisotopic Mass:
234.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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