2-methoxy-5-nitro-N-{[3-(trifluoromethyl)phenyl]methyl}aniline

2-methoxy-5-nitro-N-{[3-(trifluoromethyl)phenyl]methyl}aniline

Formula: C15H13F3N2O3

SMILES: COC1=CC=C(C=C1NCC1=CC=CC(=C1)C(F)(F)F)[N+]([O-])=O

IUPAC: 2-methoxy-5-nitro-N-{[3-(trifluoromethyl)phenyl]methyl}aniline

InChI: InChI=1S/C15H13F3N2O3/c1-23-14-6-5-12(20(21)22)8-13(14)19-9-10-3-2-4-11(7-10)15(16,17)18/h2-8,19H,9H2,1H3

Composition: C (55.22%), H (4.02%), F (17.47%), N (8.59%), O (14.71%)

Molar Mass: 326.275

Atom Count: 36

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	326.087826776
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	CSENYZXBQJEECL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.62
Topological Polar Surface Area	64.4
Polarizability	28.47
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H13F3N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00