ethyl 4-[3-(4-fluorophenyl)-1',3',4,6-tetraoxo-3a,6a-dihydro-3H-spiro[furo[3,4-c]pyrrole-1,2'-inden]-5-yl]benzoate

ethyl 4-[3-(4-fluorophenyl)-1',3',4,6-tetraoxo-3a,6a-dihydro-3H-spiro[furo[3,4-c]pyrrole-1,2'-inden]-5-yl]benzoate

Formula: C29H20FNO7

SMILES: CCOC(=O)C1=CC=C(C=C1)N1C(=O)C2C(OC3(C2C1=O)C(=O)C1=C(C=CC=C1)C3=O)C1=CC=C(F)C=C1

IUPAC: ethyl 4-[3-(4-fluorophenyl)-1',3',4,6-tetraoxo-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-inden]-5-yl]benzoate

InChI: InChI=1/C29H20FNO7/c1-2-37-28(36)16-9-13-18(14-10-16)31-26(34)21-22(27(31)35)29(38-23(21)15-7-11-17(30)12-8-15)24(32)19-5-3-4-6-20(19)25(29)33/h3-14,21-23H,2H2,1H3

Composition: C (67.84%), H (3.93%), F (3.70%), N (2.73%), O (21.81%)

Molar Mass: 513.477

Atom Count: 58

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	3
Exact Mass	513.122380151
Formal Charge	0
FSP3	0.21
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	WDRAATCJICGSLG-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	131.02
Topological Polar Surface Area	107.05
Polarizability	50.13
Ring Count	6
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H20FNO7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00