ethyl 4-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

ethyl 4-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

Formula: C18H18BrNO4

SMILES: CCOC(=O)C1=CC=C(NC(=O)COC2=CC=C(C)C=C2Br)C=C1

IUPAC: ethyl 4-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

InChI: InChI=1S/C18H18BrNO4/c1-3-23-18(22)13-5-7-14(8-6-13)20-17(21)11-24-16-9-4-12(2)10-15(16)19/h4-10H,3,11H2,1-2H3,(H,20,21)

Composition: C (55.12%), H (4.63%), Br (20.37%), N (3.57%), O (16.32%)

Molar Mass: 392.249

Atom Count: 42

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	391.041921
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YLTXGUFQZNZQGI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.32
Topological Polar Surface Area	64.63
Polarizability	36.32
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H18BrNO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00