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ethyl 3-bromo-6-nitroimidazo[1,2-a]pyridine-2-carboxylate

ethyl 3-bromo-6-nitroimidazo[1,2-a]pyridine-2-carboxylate

CAS: 1198569-36-6

Formula: C10H8BrN3O4

SMILES: CCOC(=O)C1=C(Br)N2C=C(C=CC2=N1)[N+]([O-])=O

IUPAC: ethyl 3-bromo-6-nitroimidazo[1,2-a]pyridine-2-carboxylate

InChI: InChI=1S/C10H8BrN3O4/c1-2-18-10(15)8-9(11)13-5-6(14(16)17)3-4-7(13)12-8/h3-5H,2H2,1H3

Composition: C (38.24%), H (2.57%), Br (25.44%), N (13.38%), O (20.37%)

Molar Mass: 314.095

Atom Count: 26

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 312.969819
Formal Charge 0
FSP3 0.2
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey LFMWDQFGDBAUIL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.06
Topological Polar Surface Area 86.74
Polarizability 24.63
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1198569-36-6 $51.35-$225.06$51.35$63.37$86.31$143.12$225.06
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