4-tert-butyl 2-ethyl 5-(furan-2-yl)pyrrolidine-2,4-dicarboxylate

4-tert-butyl 2-ethyl 5-(furan-2-yl)pyrrolidine-2,4-dicarboxylate

CAS: 1420651-64-4

Formula: C16H23NO5

SMILES: CCOC(=O)C1CC(C(N1)C1=CC=CO1)C(=O)OC(C)(C)C

IUPAC: 4-tert-butyl 2-ethyl 5-(furan-2-yl)pyrrolidine-2,4-dicarboxylate

InChI: InChI=1/C16H23NO5/c1-5-20-15(19)11-9-10(14(18)22-16(2,3)4)13(17-11)12-7-6-8-21-12/h6-8,10-11,13,17H,5,9H2,1-4H3

Composition: C (62.12%), H (7.49%), N (4.53%), O (25.86%)

Molar Mass: 309.362

Atom Count: 45

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	3
Exact Mass	309.157622845
Formal Charge	0
FSP3	0.62
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	MQXVIECQDKYSBE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.92
Topological Polar Surface Area	77.77
Polarizability	31.67
Ring Count	2
Rotatable Bond Count	7

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95%	<2 Days	1420651-64-4		$51.35-$359.43$51.35$63.37$86.31$225.06$359.43