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CAS Number: 63069-50-1
4-amino-3-fluorobenzonitrile

Structure

4-amino-3-fluorobenzonitrile
Name: 4-amino-3-fluorobenzonitrile
Synonyms:
General Information
Product Number: 63069501
CAS Registry Number: 63069-50-1
Name:
 
        Benzonitrile, 4-​amino-​3-​fluoro-
        2-​Fluoro-​4-​cyanoaniline; 4-​Amino-​3-​fluorobenzenecarboni​trile; 4-​Amino-​3-​fluorobenzonitrile; 4-​Cyano-​2-​fluoroaniline 
 
Chemical Formula: C7H5FN2
Exact Mass: 136.04
Molecular Weight: 136.13
m/z: 136.04 (100.0%), 137.05 (7.6%)
Elemental Analysis: C, 61.76; H, 3.70; F, 13.96; N, 20.58
 
InChI: InChI=1S/C7H5FN2/c8-6-3-5(4-9)1-2-7(6)10/h1-3H,10H2
InChIKey: RLMBRRQWBTWGMB-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1C#N)F)N

Specification

98%

References
  1. (1) Frolov, A. N.; Zhurnal Organicheskoi Khimii 1977, V13(3), P603-13 CAPLUS
  2. (2) Suh, Young-Ger; Journal of Medicinal Chemistry 2005, V48(18), P5823-5836 CAPLUS
  3. (3) Li, Fu-Nan; Bioorganic & Medicinal Chemistry 2009, V17(10), P3557-3567 CAPLUS
  4. (4) Li, Fu-Nan; Bioorganic & Medicinal Chemistry 2009, V17(24), P8149-8160 CAPLUS
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