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ethyl 5-fluorothiophene-2-carboxylate

ethyl 5-fluorothiophene-2-carboxylate

CAS: 1260379-25-6

Formula: C7H7FO2S

SMILES: CCOC(=O)C1=CC=C(F)S1

IUPAC: ethyl 5-fluorothiophene-2-carboxylate

InChI: InChI=1S/C7H7FO2S/c1-2-10-7(9)5-3-4-6(8)11-5/h3-4H,2H2,1H3

Composition: C (48.27%), H (4.05%), F (10.91%), O (18.37%), S (18.41%)

Molar Mass: 174.19

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 174.015078802
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WBYGDDWLFVJENM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.1
Topological Polar Surface Area 26.3
Polarizability 15.11
Ring Count 1
Rotatable Bond Count 3

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