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Home Nitros N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzamide

N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzamide

CAS No.:
883028-23-7
Catalog Number:
AG00IF1F
Molecular Formula:
C15H11F3N2O3
Molecular Weight:
324.2546
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Product Description
Catalog Number:
AG00IF1F
Chemical Name:
N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzamide
CAS Number:
883028-23-7
Molecular Formula:
C15H11F3N2O3
Molecular Weight:
324.2546
MDL Number:
MFCD00176416
IUPAC Name:
N-(4-methyl-3-nitrophenyl)-4-(trifluoromethyl)benzamide
InChI:
InChI=1S/C15H11F3N2O3/c1-9-2-7-12(8-13(9)20(22)23)19-14(21)10-3-5-11(6-4-10)15(16,17)18/h2-8H,1H3,(H,19,21)
InChI Key:
BYPUIHMPVYJHKV-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)[N+](=O)[O-])C
Properties
Complexity:
442  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.072g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
324.259g/mol
Monoisotopic Mass:
324.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties