| CAS Number | 1314909-17-5 |
| Catalog Number | AG01FFDS(AGN-PC-0WOLXV) |
| Chemical Name | 3-Amino-4-fluorobenzylamine |
| IUPAC Name | 5-(aminomethyl)-2-fluoroaniline |
| InChI | InChI=1S/C7H9FN2/c8-6-2-1-5(4-9)3-7(6)10/h1-3H,4,9-10H2 |
| InChI Key | KXYSHPLPGOFUTJ-UHFFFAOYSA-N |
| MDL Number | MFCD19213175 |
| Molecular Formula | C7H9FN2 |
| Molecular Weight | 140.1582 |
| SMILES | NCc1ccc(c(c1)N)F |
| Synonyms | 3-Amino-4-fluorobenzylamine,
1314909-17-5,
SCHEMBL8281240,
5-(aminomethyl)-2-fluoroaniline,
DTXSID50717414,
ZINC79387247,
AKOS006346969,
FS-6103,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.161g/mol |
| Monoisotopic Mass | 140.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number