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(4Z)-1-(4-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione

(4Z)-1-(4-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione

Formula: C14H8BrN3O5

SMILES: [O-][N+](=O)C1=CC=C(O1)C=C1C(=O)NN(C1=O)C1=CC=C(Br)C=C1

IUPAC: (4Z)-1-(4-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione

InChI: InChI=1S/C14H8BrN3O5/c15-8-1-3-9(4-2-8)17-14(20)11(13(19)16-17)7-10-5-6-12(23-10)18(21)22/h1-7H,(H,16,19)/b11-7-

Composition: C (44.47%), H (2.13%), Br (21.13%), N (11.11%), O (21.15%)

Molar Mass: 378.138

Atom Count: 31

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 376.964733
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey IDKRSUVSJPUJCF-XFFZJAGNSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.44
Topological Polar Surface Area 105.69
Polarizability 30.59
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H8BrN3O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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