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ethyl 4H-furo[3,2-b]pyrrole-5-carboxylate

ethyl 4H-furo[3,2-b]pyrrole-5-carboxylate

CAS: 35405-94-8

Formula: C9H9NO3

SMILES: CCOC(=O)C1=CC2=C(N1)C=CO2

IUPAC: ethyl 4H-furo[3,2-b]pyrrole-5-carboxylate

InChI: InChI=1S/C9H9NO3/c1-2-12-9(11)7-5-8-6(10-7)3-4-13-8/h3-5,10H,2H2,1H3

Composition: C (60.33%), H (5.06%), N (7.82%), O (26.79%)

Molar Mass: 179.175

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 179.058243154
Formal Charge 0
FSP3 0.22
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey NNABKJKQNGGLKM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.19
Topological Polar Surface Area 55.23
Polarizability 18.69
Ring Count 2
Rotatable Bond Count 3

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97% <7 Days 35405-94-8 $196.35-$2,898.50$196.35$327.25$504.90$654.50$1,972.85$2,898.50
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95% <5 Days 35405-94-8 $628.00$628.00
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