N-{2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-(methoxyimino)prop-1-en-1-yl}-4-fluoroaniline

N-{2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-(methoxyimino)prop-1-en-1-yl}-4-fluoroaniline

CAS: 320420-71-1

Formula: C16H12ClF4N3O

SMILES: CON=CC(=CNC1=CC=C(F)C=C1)C1=C(Cl)C=C(C=N1)C(F)(F)F

IUPAC: N-{2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-(methoxyimino)prop-1-en-1-yl}-4-fluoroaniline

InChI: InChI=1S/C16H12ClF4N3O/c1-25-24-8-10(7-22-13-4-2-12(18)3-5-13)15-14(17)6-11(9-23-15)16(19,20)21/h2-9,22H,1H3

Composition: C (51.42%), H (3.24%), Cl (9.49%), F (20.33%), N (11.24%), O (4.28%)

Molar Mass: 373.74

Atom Count: 37

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	373.0605024
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DWUPOIBUTNBANW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.56
Topological Polar Surface Area	46.51
Polarizability	31.54
Ring Count	2
Rotatable Bond Count	6

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