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(2E)-N-(4-chlorophenyl)-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide

(2E)-N-(4-chlorophenyl)-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide

Formula: C18H15ClN2O3

SMILES: COC1=C(OC)C(C=C(/C#N)C(=O)NC2=CC=C(Cl)C=C2)=CC=C1

IUPAC: (2E)-N-(4-chlorophenyl)-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide

InChI: InChI=1S/C18H15ClN2O3/c1-23-16-5-3-4-12(17(16)24-2)10-13(11-20)18(22)21-15-8-6-14(19)7-9-15/h3-10H,1-2H3,(H,21,22)/b13-10+

Composition: C (63.07%), H (4.41%), Cl (10.34%), N (8.17%), O (14.00%)

Molar Mass: 342.78

Atom Count: 39

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 342.0771201
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FDKBFYASZATSBL-JLHYYAGUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.12
Topological Polar Surface Area 71.35
Polarizability 35
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15ClN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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