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4-bromoquinoline-6-carboxamide

4-bromoquinoline-6-carboxamide

CAS: 2383346-49-2

Formula: C10H7BrN2O

SMILES: NC(=O)C1=CC2=C(Br)C=CN=C2C=C1

IUPAC: 4-bromoquinoline-6-carboxamide

InChI: InChI=1S/C10H7BrN2O/c11-8-3-4-13-9-2-1-6(10(12)14)5-7(8)9/h1-5H,(H2,12,14)

Composition: C (47.84%), H (2.81%), Br (31.82%), N (11.16%), O (6.37%)

Molar Mass: 251.083

Atom Count: 21

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 249.974176
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HTWULJHKDWAWRS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.68
Topological Polar Surface Area 55.98
Polarizability 22.52
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 2383346-49-2 $150.06-$216.89$150.06$216.89
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