| CAS Number | 1524195-89-8 |
| Catalog Number | AG01AWPW |
| Chemical Name | 4-{[(2-fluorophenyl)methyl]amino}pentan-1-ol |
| IUPAC Name | 4-[(2-fluorophenyl)methylamino]pentan-1-ol |
| InChI | InChI=1S/C12H18FNO/c1-10(5-4-8-15)14-9-11-6-2-3-7-12(11)13/h2-3,6-7,10,14-15H,4-5,8-9H2,1H3 |
| InChI Key | UUXHRKUNKFJYFL-UHFFFAOYSA-N |
| MDL Number | MFCD23868187 |
| Molecular Formula | C12H18FNO |
| Molecular Weight | 211.2758 |
| SMILES | CC(NCC1=C(F)C=CC=C1)CCCO |
| Synonyms | 4-{[(2-fluorophenyl)methyl]amino}pentan-1-ol,
1524195-89-8,
AKOS018863204,
EN300-162952,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.28g/mol |
| Monoisotopic Mass | 211.137g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number