4-(2-fluorobenzoyl)-1H-pyrrole-2-carboxamide

4-(2-fluorobenzoyl)-1H-pyrrole-2-carboxamide

CAS: 338976-89-9

Formula: C12H9FN2O2

SMILES: NC(=O)C1=CC(=CN1)C(=O)C1=C(F)C=CC=C1

IUPAC: 4-(2-fluorobenzoyl)-1H-pyrrole-2-carboxamide

InChI: InChI=1S/C12H9FN2O2/c13-9-4-2-1-3-8(9)11(16)7-5-10(12(14)17)15-6-7/h1-6,15H,(H2,14,17)

Composition: C (62.07%), H (3.91%), F (8.18%), N (12.06%), O (13.78%)

Molar Mass: 232.214

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	232.064805701
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	XFALXSOMBWQBNJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.56
Topological Polar Surface Area	75.95
Polarizability	22.24
Ring Count	2
Rotatable Bond Count	3

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90%	<2 Days	338976-89-9		$51.35-$524.40$51.35$63.37$86.31$524.40