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(2E)-2-cyano-3-(2,3-dichlorophenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide

(2E)-2-cyano-3-(2,3-dichlorophenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide

Formula: C15H14Cl2N2O2

SMILES: ClC1=C(Cl)C(C=C(/C#N)C(=O)NCC2CCCO2)=CC=C1

IUPAC: (2E)-2-cyano-3-(2,3-dichlorophenyl)-N-[(oxolan-2-yl)methyl]prop-2-enamide

InChI: InChI=1/C15H14Cl2N2O2/c16-13-5-1-3-10(14(13)17)7-11(8-18)15(20)19-9-12-4-2-6-21-12/h1,3,5,7,12H,2,4,6,9H2,(H,19,20)/b11-7+

Composition: C (55.40%), H (4.34%), Cl (21.80%), N (8.61%), O (9.84%)

Molar Mass: 325.19

Atom Count: 35

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 324.0432331
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QOEPMWFQTMPWII-YRNVUSSQNA-N
Lipinski's Rule of Five 1
Molar Refractivity 82.7
Topological Polar Surface Area 62.12
Polarizability 31.51
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H14Cl2N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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