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methyl thieno[2,3-b]pyridine-5-carboxylate

methyl thieno[2,3-b]pyridine-5-carboxylate

CAS: 21344-30-9

Formula: C9H7NO2S

SMILES: COC(=O)C1=CN=C2SC=CC2=C1

IUPAC: methyl thieno[2,3-b]pyridine-5-carboxylate

InChI: InChI=1S/C9H7NO2S/c1-12-9(11)7-4-6-2-3-13-8(6)10-5-7/h2-5H,1H3

Composition: C (55.95%), H (3.65%), N (7.25%), O (16.56%), S (16.59%)

Molar Mass: 193.22

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 193.019749643
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey LGMOLZCKSVYQNA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.22
Topological Polar Surface Area 39.19
Polarizability 19.38
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 21344-30-9 $234.55-$358.12$234.55$358.12
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