| CAS Number | 1864073-26-6 |
| Catalog Number | AG01AUDO |
| Chemical Name | 2-(1,1-Difluoroethyl)aniline hydrochloride |
| IUPAC Name | 2-(1,1-difluoroethyl)aniline;hydrochloride |
| InChI | InChI=1S/C8H9F2N.ClH/c1-8(9,10)6-4-2-3-5-7(6)11;/h2-5H,11H2,1H3;1H |
| InChI Key | IRSKCNQTNZGDDO-UHFFFAOYSA-N |
| MDL Number | MFCD29034853 |
| Molecular Formula | C8H10ClF2N |
| Molecular Weight | 193.6215 |
| SMILES | Cl.CC(C1=C(N)C=CC=C1)(F)F |
| Synonyms | 2-(1,1-difluoroethyl)aniline hydrochloride,
1864073-26-6,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.622g/mol |
| Monoisotopic Mass | 193.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number