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propyl 3-cyclohexyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,?]dec-8-ene-6-carboxylate

propyl 3-cyclohexyl-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,?]dec-8-ene-6-carboxylate

Formula: C18H25NO4

SMILES: CCCOC(=O)C1C2OC3(CN(C4CCCCC4)C(=O)C13)C=C2

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

InChI: InChI=1/C18H25NO4/c1-2-10-22-17(21)14-13-8-9-18(23-13)11-19(16(20)15(14)18)12-6-4-3-5-7-12/h8-9,12-15H,2-7,10-11H2,1H3

Composition: C (67.69%), H (7.89%), N (4.39%), O (20.04%)

Molar Mass: 319.401

Atom Count: 48

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 4
Exact Mass 319.178358289
Formal Charge 0
FSP3 0.78
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LGIAPXVOZIRQPS-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.01
Topological Polar Surface Area 55.84
Polarizability 33.42
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H25NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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