6-Fluoro-1H-indole-3-carboxylic acid


Chemical Name: 6-Fluoro-1H-indole-3-carboxylic acid
CAS Number: 23077-44-3
Product Number: AG002M59(AGN-PC-05EXP5)
Synonyms:
MDL No:
Molecular Formula: C9H6FNO2
Molecular Weight: 179.1478

Identification/Properties


Computed Properties
Molecular Weight:
179.15g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
179.038g/mol
Monoisotopic Mass:
179.038g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
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

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NMR Spectrum


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