| CAS Number | 1216003-55-2 |
| Catalog Number | AG01AFL4 |
| Chemical Name | 5-(4-Fluorophenyl)pentan-1-amine |
| IUPAC Name | 5-(4-fluorophenyl)pentan-1-amine |
| InChI | InChI=1S/C11H16FN/c12-11-7-5-10(6-8-11)4-2-1-3-9-13/h5-8H,1-4,9,13H2 |
| InChI Key | VFCCGVDBQTUFMJ-UHFFFAOYSA-N |
| MDL Number | MFCD14529677 |
| Molecular Formula | C11H16FN |
| Molecular Weight | 181.2498 |
| SMILES | NCCCCCC1=CC=C(F)C=C1 |
| Synonyms | 5-(4-fluorophenyl)pentan-1-amine,
1216003-55-2,
SCHEMBL1567051,
ZINC36156393,
AKOS014320270,
MCULE-5102756655,
NE30013,
Z1762997544,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.254g/mol |
| Monoisotopic Mass | 181.127g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number