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

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

Formula: C17H16ClNO4

SMILES: CCOC(=O)C1C2OC3(CN(C(=O)C13)C1=CC=CC=C1Cl)C=C2

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

InChI: InChI=1/C17H16ClNO4/c1-2-22-16(21)13-12-7-8-17(23-12)9-19(15(20)14(13)17)11-6-4-3-5-10(11)18/h3-8,12-14H,2,9H2,1H3

Composition: C (61.18%), H (4.83%), Cl (10.62%), N (4.20%), O (19.17%)

Molar Mass: 333.77

Atom Count: 39

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	333.0767857
Formal Charge	0
FSP3	0.41
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FKNCJQGBTGGTFC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.05
Topological Polar Surface Area	55.84
Polarizability	32.76
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H16ClNO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00