N-[(3-bromo-4-methoxyphenyl)methyl]-2-methyl-4-nitroaniline

N-[(3-bromo-4-methoxyphenyl)methyl]-2-methyl-4-nitroaniline

Formula: C15H15BrN2O3

SMILES: COC1=CC=C(CNC2=CC=C(C=C2C)[N+]([O-])=O)C=C1Br

IUPAC: N-[(3-bromo-4-methoxyphenyl)methyl]-2-methyl-4-nitroaniline

InChI: InChI=1S/C15H15BrN2O3/c1-10-7-12(18(19)20)4-5-14(10)17-9-11-3-6-15(21-2)13(16)8-11/h3-8,17H,9H2,1-2H3

Composition: C (51.30%), H (4.31%), Br (22.75%), N (7.98%), O (13.67%)

Molar Mass: 351.2

Atom Count: 36

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	350.026605
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DADJHEDPEWIVDU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.31
Topological Polar Surface Area	64.4
Polarizability	31.87
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H15BrN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00