N-[4-bromo-3-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide

N-[4-bromo-3-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide

Formula: C15H10BrF3N2O3

SMILES: CC1=CC(=CC=C1[N+]([O-])=O)C(=O)NC1=CC=C(Br)C(=C1)C(F)(F)F

IUPAC: N-[4-bromo-3-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide

InChI: InChI=1S/C15H10BrF3N2O3/c1-8-6-9(2-5-13(8)21(23)24)14(22)20-10-3-4-12(16)11(7-10)15(17,18)19/h2-7H,1H3,(H,20,22)

Composition: C (44.69%), H (2.50%), Br (19.82%), F (14.14%), N (6.95%), O (11.91%)

Molar Mass: 403.155

Atom Count: 34

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	401.98269
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	AFYMRWWKNOCRMD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	86.55
Topological Polar Surface Area	72.24
Polarizability	30.85
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H10BrF3N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00