| CAS Number | 93750-33-5 |
| Catalog Number | AG019WIW(AGN-PC-0169IP) |
| Chemical Name | 1-(4-fluorophenoxy)propan-2-amine |
| IUPAC Name | 1-(4-fluorophenoxy)propan-2-amine |
| InChI | InChI=1S/C9H12FNO/c1-7(11)6-12-9-4-2-8(10)3-5-9/h2-5,7H,6,11H2,1H3 |
| InChI Key | SHHSHEWVMNXSKZ-UHFFFAOYSA-N |
| MDL Number | MFCD06247711 |
| Molecular Formula | C9H12FNO |
| Molecular Weight | 169.1961 |
| SMILES | CC(COC1=CC=C(F)C=C1)N |
| Synonyms | 1-(2-aminopropoxy)-4-fluorobenzene,
93750-33-5,
1-(4-fluorophenoxy)propan-2-amine,
1-(4-Fluorophenoxy)-2-propanamine,
AC1Q2BCE,
CTK6A8912,
AKOS009139879,
NE44221,
[2-(4-fluorophenoxy)-1-methylethyl]amine,
TR-043007,
EN300-52127,
Z752989124,
2-Propanamine, 1-(4-fluorophenoxy),
2-(4-FLUOROPHENOXY)-N-METHYL-1-ETHANAMINE,
1193389-16-0,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.199g/mol |
| Monoisotopic Mass | 169.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number