Text Search
Structure Search

methyl 4-[2-(4-bromophenyl)acetamido]benzoate

methyl 4-[2-(4-bromophenyl)acetamido]benzoate

Formula: C16H14BrNO3

SMILES: COC(=O)C1=CC=C(NC(=O)CC2=CC=C(Br)C=C2)C=C1

IUPAC: methyl 4-[2-(4-bromophenyl)acetamido]benzoate

InChI: InChI=1S/C16H14BrNO3/c1-21-16(20)12-4-8-14(9-5-12)18-15(19)10-11-2-6-13(17)7-3-11/h2-9H,10H2,1H3,(H,18,19)

Composition: C (55.19%), H (4.05%), Br (22.95%), N (4.02%), O (13.78%)

Molar Mass: 348.196

Atom Count: 35

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 347.015706
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DFKNYHLACLVDRK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.29
Topological Polar Surface Area 55.4
Polarizability 32
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H14BrNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote