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benzyl 3-(2-ethylphenyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,?]dec-8-ene-6-carboxylate

benzyl 3-(2-ethylphenyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,?]dec-8-ene-6-carboxylate

Formula: C24H23NO4

SMILES: CCC1=CC=CC=C1N1CC23OC(C=C2)C(C3C1=O)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 3-(2-ethylphenyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,?]dec-8-ene-6-carboxylate

InChI: InChI=1/C24H23NO4/c1-2-17-10-6-7-11-18(17)25-15-24-13-12-19(29-24)20(21(24)22(25)26)23(27)28-14-16-8-4-3-5-9-16/h3-13,19-21H,2,14-15H2,1H3

Composition: C (74.02%), H (5.95%), N (3.60%), O (16.43%)

Molar Mass: 389.451

Atom Count: 52

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 4
Exact Mass 389.162708225
Formal Charge 0
FSP3 0.33
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YRRZXGKUQSATMT-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.75
Topological Polar Surface Area 55.84
Polarizability 42.17
Ring Count 5
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H23NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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