| CAS Number | 1279852-41-3 |
| Catalog Number | AG01DSS4 |
| Chemical Name | 1-(3,5-dichlorophenyl)-2-phenylethan-1-amine hydrochloride |
| IUPAC Name | 1-(3,5-dichlorophenyl)-2-phenylethanamine;hydrochloride |
| InChI | InChI=1S/C14H13Cl2N.ClH/c15-12-7-11(8-13(16)9-12)14(17)6-10-4-2-1-3-5-10;/h1-5,7-9,14H,6,17H2;1H |
| InChI Key | MKHYOLXDPKHKCL-UHFFFAOYSA-N |
| MDL Number | MFCD31558686 |
| Molecular Formula | C14H14Cl3N |
| Molecular Weight | 302.6267 |
| SMILES | Cl.NC(C1=CC(Cl)=CC(Cl)=C1)CC1=CC=CC=C1 |
| Synonyms | 1-(3,5-dichlorophenyl)-2-phenylethan-1-amine hydrochloride,
1279852-41-3,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.623g/mol |
| Monoisotopic Mass | 301.019g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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