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ethyl 2-(methylsulfanyl)indolizine-3-carboxylate

ethyl 2-(methylsulfanyl)indolizine-3-carboxylate

Formula: C12H13NO2S

SMILES: CCOC(=O)C1=C(SC)C=C2C=CC=CN12

IUPAC: ethyl 2-(methylsulfanyl)indolizine-3-carboxylate

InChI: InChI=1S/C12H13NO2S/c1-3-15-12(14)11-10(16-2)8-9-6-4-5-7-13(9)11/h4-8H,3H2,1-2H3

Composition: C (61.25%), H (5.57%), N (5.95%), O (13.60%), S (13.63%)

Molar Mass: 235.3

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 235.066699837
Formal Charge 0
FSP3 0.25
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WMIFFHDUCARTFF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.55
Topological Polar Surface Area 30.71
Polarizability 26.01
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
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Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C12H13NO2S Quote Only