2-(4-bromophenyl)-2-oxoethyl 2-{4'-nitro-[1,1'-biphenyl]-4-yl}-1,3-dioxoisoindole-5-carboxylate

2-(4-bromophenyl)-2-oxoethyl 2-{4'-nitro-[1,1'-biphenyl]-4-yl}-1,3-dioxoisoindole-5-carboxylate

Formula: C29H17BrN2O7

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(C=C1)N1C(=O)C2=CC=C(C=C2C1=O)C(=O)OCC(=O)C1=CC=C(Br)C=C1

IUPAC: 2-(4-bromophenyl)-2-oxoethyl 2-{4'-nitro-[1,1'-biphenyl]-4-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

InChI: InChI=1S/C29H17BrN2O7/c30-21-8-1-19(2-9-21)26(33)16-39-29(36)20-7-14-24-25(15-20)28(35)31(27(24)34)22-10-3-17(4-11-22)18-5-12-23(13-6-18)32(37)38/h1-15H,16H2

Composition: C (59.50%), H (2.93%), Br (13.65%), N (4.79%), O (19.13%)

Molar Mass: 585.366

Atom Count: 56

Heavy Atom Count: 39

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	584.021914
Formal Charge	0
FSP3	0.03
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	RIYCMGVCSKUWBS-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	145
Topological Polar Surface Area	123.89
Polarizability	55.57
Ring Count	5
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H17BrN2O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00