| CAS Number | 1193389-33-1 |
| Catalog Number | AG019VSZ |
| Chemical Name | [(3,4-Difluorophenyl)methyl](ethyl)amine hydrochloride |
| IUPAC Name | N-[(3,4-difluorophenyl)methyl]ethanamine;hydrochloride |
| InChI | InChI=1S/C9H11F2N.ClH/c1-2-12-6-7-3-4-8(10)9(11)5-7;/h3-5,12H,2,6H2,1H3;1H |
| InChI Key | DUGSVGFBYSVWDI-UHFFFAOYSA-N |
| MDL Number | MFCD12197238 |
| Molecular Formula | C9H12ClF2N |
| Molecular Weight | 207.6481 |
| SMILES | Cl.CCNCC1=CC(F)=C(F)C=C1 |
| Synonyms | [(3,4-difluorophenyl)methyl](ethyl)amine hydrochloride,
1193389-33-1,
AC1Q39VJ,
MCULE-6417698119,
NE56823,
EN300-49095,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.649g/mol |
| Monoisotopic Mass | 207.063g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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