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1,3-diethyl 2-{[(3,5-dimethoxyphenyl)imino]methyl}propanedioate

1,3-diethyl 2-{[(3,5-dimethoxyphenyl)imino]methyl}propanedioate

Formula: C16H21NO6

SMILES: CCOC(=O)C(C=NC1=CC(OC)=CC(OC)=C1)C(=O)OCC

IUPAC: 1,3-diethyl 2-{[(3,5-dimethoxyphenyl)imino]methyl}propanedioate

InChI: InChI=1S/C16H21NO6/c1-5-22-15(18)14(16(19)23-6-2)10-17-11-7-12(20-3)9-13(8-11)21-4/h7-10,14H,5-6H2,1-4H3

Composition: C (59.43%), H (6.55%), N (4.33%), O (29.69%)

Molar Mass: 323.345

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 323.1368874
Formal Charge 0
FSP3 0.44
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey AHMZDMFSQGOIOS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.06
Topological Polar Surface Area 83.42
Polarizability 32.4
Ring Count 1
Rotatable Bond Count 10

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H21NO6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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