| CAS Number | 1956382-42-5 |
| Catalog Number | AG00I3IP(AGN-PC-0WP0TS) |
| Chemical Name | Phenetrazine Hydrochloride |
| IUPAC Name | 3-ethyl-2-phenylmorpholine;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c1-2-11-12(14-9-8-13-11)10-6-4-3-5-7-10;/h3-7,11-13H,2,8-9H2,1H3;1H |
| InChI Key | JBDLPMIDSZBBQJ-UHFFFAOYSA-N |
| MDL Number | MFCD29921184 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | Cl.C(C)C1C(OCCN1)c1ccccc1 |
| Synonyms | 3-Ethyl-2-phenylmorpholine HCl,
1956382-42-5,
MFCD29921184,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.732g/mol |
| Monoisotopic Mass | 227.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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