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

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

Formula: C20H23NO4

SMILES: CCCOC(=O)C1C2OC3(CN(C(=O)C13)C1=CC=CC=C1CC)C=C2

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

InChI: InChI=1/C20H23NO4/c1-3-11-24-19(23)16-15-9-10-20(25-15)12-21(18(22)17(16)20)14-8-6-5-7-13(14)4-2/h5-10,15-17H,3-4,11-12H2,1-2H3

Composition: C (70.36%), H (6.79%), N (4.10%), O (18.74%)

Molar Mass: 341.407

Atom Count: 48

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 341.162708225
Formal Charge 0
FSP3 0.5
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey XMHRYTPYLIGRKD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.41
Topological Polar Surface Area 55.84
Polarizability 36.27
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H23NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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