N-(3-chloro-4-fluorophenyl)prop-2-enamide

N-(3-chloro-4-fluorophenyl)prop-2-enamide

CAS: 1156926-45-2

Formula: C9H7ClFNO

SMILES: FC1=CC=C(NC(=O)C=C)C=C1Cl

IUPAC: N-(3-chloro-4-fluorophenyl)prop-2-enamide

InChI: InChI=1S/C9H7ClFNO/c1-2-9(13)12-6-3-4-8(11)7(10)5-6/h2-5H,1H2,(H,12,13)

Composition: C (54.16%), H (3.53%), Cl (17.76%), F (9.52%), N (7.02%), O (8.02%)

Molar Mass: 199.61

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	199.0200197
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	AKKPOFLHKDFKGJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.59
Topological Polar Surface Area	29.1
Polarizability	18.43
Ring Count	1
Rotatable Bond Count	2

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95%	<2 Days	1156926-45-2		$51.35-$86.31$51.35$63.37$86.31