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140-75-0 | Benzenemethanamine, 4-fluoro-
CAS No: 140-75-0 Catalog No: AG001BXB MDL No:MFCD00008120
Product Description
Catalog Number:
AG001BXB
Chemical Name:
Benzenemethanamine, 4-fluoro-
CAS Number:
140-75-0
Molecular Formula:
C7H8FN
Molecular Weight:
125.1435
MDL Number:
MFCD00008120
IUPAC Name:
(4-fluorophenyl)methanamine
InChI:
InChI=1S/C7H8FN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2
InChI Key:
IIFVWLUQBAIPMJ-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)F
EC Number:
205-430-4
NSC Number:
158269
Properties
Complexity:
77
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.146g/mol
Monoisotopic Mass:
125.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Amine-reactive polymers synthesized by RAFT polymerization using an azlactone functional trithiocarbonate RAFT agent. | Macromolecular rapid communications 20121026 |
| N-(4-Fluoro-benz-yl)-3-nitro-pyridine-2,6-diamine. | Acta crystallographica. Section E, Structure reports online 20110601 |
| 7-(4-Fluoro-benzyl-amino)-2-phenyl-1,2,4-triazolo[1,5-a][1,3,5]triazin-5-amine methanol disolvate. | Acta crystallographica. Section E, Structure reports online 20110501 |
| Synthesis and application of 4-[(18)F]fluorobenzylamine: A versatile building block for the preparation of PET radiotracers. | Organic & biomolecular chemistry 20101021 |
| [New derivatives of eremomycin containing (15)n or f atoms for NMR study]. | Bioorganicheskaia khimiia 20080101 |
| New efficient substrates for semicarbazide-sensitive amine oxidase/VAP-1 enzyme: analysis by SARs and computational docking. | Journal of medicinal chemistry 20061019 |
| Synthesis and preclinical evaluation of a folic acid derivative labeled with 18F for PET imaging of folate receptor-positive tumors. | Journal of nuclear medicine : official publication, Society of Nuclear Medicine 20060701 |
| Simple, intuitive calculations of free energy of binding for protein-ligand complexes. 1. Models without explicit constrained water. | Journal of medicinal chemistry 20020606 |
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