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Home > Fluorides > 333778-05-5
333778-05-5 | 2-[4-(2,2-Dicyano-vinyl)-phenoxy]-N-(3-trifluoromethyl-phenyl)-acetamide
CAS No: 333778-05-5 Catalog No: AG01EVF9 MDL No:
Product Description
Catalog Number:
AG01EVF9
Chemical Name:
2-[4-(2,2-Dicyano-vinyl)-phenoxy]-N-(3-trifluoromethyl-phenyl)-acetamide
CAS Number:
333778-05-5
Molecular Formula:
C19H12F3N3O2
Molecular Weight:
371.3127
IUPAC Name:
2-[4-(2,2-dicyanoethenyl)phenoxy]-N-[3-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C19H12F3N3O2/c20-19(21,22)15-2-1-3-16(9-15)25-18(26)12-27-17-6-4-13(5-7-17)8-14(10-23)11-24/h1-9H,12H2,(H,25,26)
InChI Key:
FHRZZJUBFGTASU-UHFFFAOYSA-N
SMILES:
N#CC(=Cc1ccc(cc1)OCC(=O)Nc1cccc(c1)C(F)(F)F)C#N
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.088g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
371.319g/mol
Monoisotopic Mass:
371.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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