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4-cyano-N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylidene]-2-fluorobenzohydrazide

4-cyano-N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylidene]-2-fluorobenzohydrazide

Formula: C17H12FN3O3

SMILES: FC1=CC(=CC=C1C(=O)NN=CC1=CC=C2OCCOC2=C1)C#N

IUPAC: 4-cyano-N'-[(E)-(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-2-fluorobenzohydrazide

InChI: InChI=1S/C17H12FN3O3/c18-14-7-11(9-19)1-3-13(14)17(22)21-20-10-12-2-4-15-16(8-12)24-6-5-23-15/h1-4,7-8,10H,5-6H2,(H,21,22)/b20-10+

Composition: C (62.77%), H (3.72%), F (5.84%), N (12.92%), O (14.75%)

Molar Mass: 325.299

Atom Count: 36

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 325.086269421
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey YXLHUBSJLMLGRR-KEBDBYFISA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.13
Topological Polar Surface Area 83.71
Polarizability 31.19
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H12FN3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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