3-(4-chlorobenzoyl)-4-(furan-2-yl)-1-methylpyrrolidine

3-(4-chlorobenzoyl)-4-(furan-2-yl)-1-methylpyrrolidine

CAS: 478043-76-4

Formula: C16H16ClNO2

SMILES: CN1CC(C(C1)C1=CC=CO1)C(=O)C1=CC=C(Cl)C=C1

IUPAC: 3-(4-chlorobenzoyl)-4-(furan-2-yl)-1-methylpyrrolidine

InChI: InChI=1/C16H16ClNO2/c1-18-9-13(15-3-2-8-20-15)14(10-18)16(19)11-4-6-12(17)7-5-11/h2-8,13-14H,9-10H2,1H3

Composition: C (66.32%), H (5.57%), Cl (12.23%), N (4.83%), O (11.04%)

Molar Mass: 289.76

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	289.0869565
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FIMPJCWBSXAFIG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.25
Topological Polar Surface Area	33.45
Polarizability	30.55
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	478043-76-4		$51.35-$86.31$51.35$63.37$86.31