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157554-73-9 | Acetamide, N-[2-amino-4-bromo-5-(trifluoromethyl)phenyl]-
CAS No: 157554-73-9 Catalog No: AG001PIE MDL No:MFCD09263996
Product Description
Catalog Number:
AG001PIE
Chemical Name:
Acetamide, N-[2-amino-4-bromo-5-(trifluoromethyl)phenyl]-
CAS Number:
157554-73-9
Molecular Formula:
C9H8BrF3N2O
Molecular Weight:
297.0718
MDL Number:
MFCD09263996
IUPAC Name:
N-[2-amino-4-bromo-5-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C9H8BrF3N2O/c1-4(16)15-8-2-5(9(11,12)13)6(10)3-7(8)14/h2-3H,14H2,1H3,(H,15,16)
InChI Key:
JFFIUMYQUMQVNO-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(c(cc1N)Br)C(F)(F)F
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.977g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.075g/mol
Monoisotopic Mass:
295.977g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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