2-amino-6-fluoro-1-benzothiophene-3-carbonitrile


Chemical Name: 2-amino-6-fluoro-1-benzothiophene-3-carbonitrile
CAS Number: 221061-09-2
Product Number: AG00708W(AGN-PC-01VSJO)
Synonyms:
MDL No:
Molecular Formula: C9H5FN2S
Molecular Weight: 192.2128

Identification/Properties


Computed Properties
Molecular Weight:
192.211g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
192.016g/mol
Monoisotopic Mass:
192.016g/mol
Topological Polar Surface Area:
78A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
249
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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