| CAS Number | 1183031-78-8 |
| Catalog Number | AG01AA3V |
| Chemical Name | 2-(3-Fluorophenyl)-2-(methylamino)ethan-1-ol |
| IUPAC Name | 2-(3-fluorophenyl)-2-(methylamino)ethanol |
| InChI | InChI=1S/C9H12FNO/c1-11-9(6-12)7-3-2-4-8(10)5-7/h2-5,9,11-12H,6H2,1H3 |
| InChI Key | BJZJXKOFBIKLHY-UHFFFAOYSA-N |
| MDL Number | MFCD12781699 |
| Molecular Formula | C9H12FNO |
| Molecular Weight | 169.1961 |
| SMILES | CNC(C1=CC(F)=CC=C1)CO |
| Synonyms | 2-(3-fluorophenyl)-2-(methylamino)ethan-1-ol,
1183031-78-8,
AC1Q40U7,
SCHEMBL13485380,
AKOS005265607,
MCULE-5585322405,
NE55891,
EN300-66968,
Z1263529678,
|
| Complexity | 132 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.199g/mol |
| Monoisotopic Mass | 169.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number