Text Search
Structure Search

2-oxo-2-phenylethyl 1H,2H,3H-cyclopenta[b]quinoline-9-carboxylate

2-oxo-2-phenylethyl 1H,2H,3H-cyclopenta[b]quinoline-9-carboxylate

Formula: C21H17NO3

SMILES: O=C(COC(=O)C1=C2CCCC2=NC2=CC=CC=C12)C1=CC=CC=C1

IUPAC: 2-oxo-2-phenylethyl 1H,2H,3H-cyclopenta[b]quinoline-9-carboxylate

InChI: InChI=1S/C21H17NO3/c23-19(14-7-2-1-3-8-14)13-25-21(24)20-15-9-4-5-11-17(15)22-18-12-6-10-16(18)20/h1-5,7-9,11H,6,10,12-13H2

Composition: C (76.12%), H (5.17%), N (4.23%), O (14.48%)

Molar Mass: 331.371

Atom Count: 42

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 331.120843411
Formal Charge 0
FSP3 0.19
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey WGCGPGZWRKMFHQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.36
Topological Polar Surface Area 56.26
Polarizability 37.51
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 C21H17NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote