2-chloro-N-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]acetamide

2-chloro-N-(pyridin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]acetamide

CAS: 1397207-90-7

Formula: C15H12ClF3N2O

SMILES: FC(F)(F)C1=CC=C(C=C1)N(CC1=CC=NC=C1)C(=O)CCl

IUPAC: 2-chloro-N-[(pyridin-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]acetamide

InChI: InChI=1S/C15H12ClF3N2O/c16-9-14(22)21(10-11-5-7-20-8-6-11)13-3-1-12(2-4-13)15(17,18)19/h1-8H,9-10H2

Composition: C (54.81%), H (3.68%), Cl (10.78%), F (17.34%), N (8.52%), O (4.87%)

Molar Mass: 328.72

Atom Count: 34

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	328.0590252
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QQEDQRUSNVMRQI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.22
Topological Polar Surface Area	33.2
Polarizability	28.72
Ring Count	2
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1397207-90-7		$1,474.00-$3,894.00$1,474.00$2,596.00$3,894.00