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methyl 2-{4-[(E)-({[3-(trifluoromethyl)phenyl]formamido}imino)methyl]phenoxy}acetate

methyl 2-{4-[(E)-({[3-(trifluoromethyl)phenyl]formamido}imino)methyl]phenoxy}acetate

Formula: C18H15F3N2O4

SMILES: COC(=O)COC1=CC=C(C=NNC(=O)C2=CC=CC(=C2)C(F)(F)F)C=C1

IUPAC: methyl 2-{4-[(E)-({[3-(trifluoromethyl)phenyl]formamido}imino)methyl]phenoxy}acetate

InChI: InChI=1S/C18H15F3N2O4/c1-26-16(24)11-27-15-7-5-12(6-8-15)10-22-23-17(25)13-3-2-4-14(9-13)18(19,20)21/h2-10H,11H2,1H3,(H,23,25)/b22-10+

Composition: C (56.85%), H (3.98%), F (14.99%), N (7.37%), O (16.83%)

Molar Mass: 380.323

Atom Count: 42

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 380.09839146
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey YYFUJCNENBSYRY-LSHDLFTRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.53
Topological Polar Surface Area 76.99
Polarizability 33.49
Ring Count 2
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15F3N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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