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4,5-dibromo-3-fluorothiophene-2-carboxylic acid

4,5-dibromo-3-fluorothiophene-2-carboxylic acid

Formula: C5HBr2FO2S

SMILES: OC(=O)C1=C(F)C(Br)=C(Br)S1

IUPAC: 4,5-dibromo-3-fluorothiophene-2-carboxylic acid

InChI: InChI=1S/C5HBr2FO2S/c6-1-2(8)3(5(9)10)11-4(1)7/h(H,9,10)

Composition: C (19.76%), H (0.33%), Br (52.58%), F (6.25%), O (10.53%), S (10.55%)

Molar Mass: 303.93

Atom Count: 12

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 301.804805
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JAARIXSMRWKNFX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.83
Topological Polar Surface Area 37.3
Polarizability 17.77
Ring Count 1
Rotatable Bond Count 1

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