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ethyl 5-amino-2-chloropyridine-4-carboxylate

ethyl 5-amino-2-chloropyridine-4-carboxylate

CAS: 862314-10-1

Formula: C8H9ClN2O2

SMILES: CCOC(=O)C1=CC(Cl)=NC=C1N

IUPAC: ethyl 5-amino-2-chloropyridine-4-carboxylate

InChI: InChI=1S/C8H9ClN2O2/c1-2-13-8(12)5-3-7(9)11-4-6(5)10/h3-4H,2,10H2,1H3

Composition: C (47.90%), H (4.52%), Cl (17.67%), N (13.96%), O (15.95%)

Molar Mass: 200.62

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 200.0352552
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZYJCTOLZHAXVCQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.24
Topological Polar Surface Area 65.21
Polarizability 18.84
Ring Count 1
Rotatable Bond Count 3

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 862314-10-1 $51.35-$449.02$51.35$63.37$86.31$292.79$449.02
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