ethyl 4-fluoro-1-benzothiophene-2-carboxylate


Chemical Name: ethyl 4-fluoro-1-benzothiophene-2-carboxylate
CAS Number: 1263280-02-9
Product Number: AG000SL2(AGN-PC-07YK8U)
Synonyms:
MDL No:
Molecular Formula: C11H9FO2S
Molecular Weight: 224.2514

Identification/Properties


Computed Properties
Molecular Weight:
224.249g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
224.031g/mol
Monoisotopic Mass:
224.031g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
247
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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