| CAS Number | 1020993-12-7 |
| Catalog Number | AG01A2E3 |
| Chemical Name | 2-[(2,4-Difluorophenyl)amino]ethan-1-ol |
| IUPAC Name | 2-(2,4-difluoroanilino)ethanol |
| InChI | InChI=1S/C8H9F2NO/c9-6-1-2-8(7(10)5-6)11-3-4-12/h1-2,5,11-12H,3-4H2 |
| InChI Key | RRESLJQYYBSQTG-UHFFFAOYSA-N |
| MDL Number | MFCD11153579 |
| Molecular Formula | C8H9F2NO |
| Molecular Weight | 173.1600 |
| SMILES | OCCNC1=CC=C(F)C=C1F |
| Synonyms | 2-[(2,4-difluorophenyl)amino]ethan-1-ol,
1020993-12-7,
SCHEMBL5225550,
ZINC20053346,
AKOS000259574,
NE43284,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.163g/mol |
| Monoisotopic Mass | 173.065g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number