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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide

(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide

Formula: C19H14ClF3N2O2

SMILES: CCOC1=CC=C(C=C(/C#N)C(=O)NC2=CC(=CC=C2Cl)C(F)(F)F)C=C1

IUPAC: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide

InChI: InChI=1S/C19H14ClF3N2O2/c1-2-27-15-6-3-12(4-7-15)9-13(11-24)18(26)25-17-10-14(19(21,22)23)5-8-16(17)20/h3-10H,2H2,1H3,(H,25,26)/b13-9+

Composition: C (57.81%), H (3.57%), Cl (8.98%), F (14.44%), N (7.10%), O (8.11%)

Molar Mass: 394.78

Atom Count: 41

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 394.0695899
Formal Charge 0
FSP3 0.16
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UGLGHIFGXUTUNM-UKTHLTGXSA-N
Lipinski's Rule of Five
Molar Refractivity 98.38
Topological Polar Surface Area 62.12
Polarizability 35.45
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H14ClF3N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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