| CAS Number | 1378822-67-3 |
| Catalog Number | AG01FFE7(AGN-PC-3H4A58) |
| Chemical Name | 3-(aminomethyl)-5-fluoroaniline |
| IUPAC Name | 3-(aminomethyl)-5-fluoroaniline |
| InChI | InChI=1S/C7H9FN2/c8-6-1-5(4-9)2-7(10)3-6/h1-3H,4,9-10H2 |
| InChI Key | KEIXKVWNQGTZAQ-UHFFFAOYSA-N |
| MDL Number | MFCD12546117 |
| Molecular Formula | C7H9FN2 |
| Molecular Weight | 140.1582 |
| SMILES | NCc1cc(N)cc(c1)F |
| Synonyms | 5-Amino-3-fluorobenzylamine,
1378822-67-3,
ZINC79387697,
AKOS022807349,
AB65614,
FS-5878,
|
| 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 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number