(2E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

(2E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

Formula: C17H9ClF3N3O3

SMILES: [O-][N+](=O)C1=CC(Cl)=CC=C1NC(=O)C(=CC1=CC=CC(=C1)C(F)(F)F)C#N

IUPAC: (2E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

InChI: InChI=1S/C17H9ClF3N3O3/c18-13-4-5-14(15(8-13)24(26)27)23-16(25)11(9-22)6-10-2-1-3-12(7-10)17(19,20)21/h1-8H,(H,23,25)/b11-6+

Composition: C (51.60%), H (2.29%), Cl (8.96%), F (14.40%), N (10.62%), O (12.13%)

Molar Mass: 395.72

Atom Count: 36

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	395.0284534
Formal Charge	0
FSP3	0.06
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GNDZLFKRWBELTI-IZZDOVSWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.49
Topological Polar Surface Area	96.03
Polarizability	33.14
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H9ClF3N3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00