| CAS Number | 1286264-86-5 |
| Catalog Number | AG01DV72 |
| Chemical Name | 3-Fluoro-2-isobutoxyaniline |
| IUPAC Name | 3-fluoro-2-(2-methylpropoxy)aniline |
| InChI | InChI=1S/C10H14FNO/c1-7(2)6-13-10-8(11)4-3-5-9(10)12/h3-5,7H,6,12H2,1-2H3 |
| InChI Key | OTZYSFFXNXHFPA-UHFFFAOYSA-N |
| MDL Number | MFCD17014192 |
| Molecular Formula | C10H14FNO |
| Molecular Weight | 183.2227 |
| SMILES | CC(COC1=C(F)C=CC=C1N)C |
| Synonyms | 3-Fluoro-2-isobutoxyaniline,
1286264-86-5,
3-fluoro-2-(2-methylpropoxy)aniline,
ZINC67800864,
KS-5719,
A1-06917,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.226g/mol |
| Monoisotopic Mass | 183.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number