| CAS Number | 2126178-41-2 |
| Catalog Number | AG01E7C6 |
| Chemical Name | 3,5-dimethyl-2-phenylmorpholine hydrochloride |
| IUPAC Name | 3,5-dimethyl-2-phenylmorpholine;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c1-9-8-14-12(10(2)13-9)11-6-4-3-5-7-11;/h3-7,9-10,12-13H,8H2,1-2H3;1H |
| InChI Key | OBEVOFMPURVTHI-UHFFFAOYSA-N |
| MDL Number | MFCD30752449 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | Cl.CC1NC(C)C(C2=CC=CC=C2)OC1 |
| Synonyms | 3,5-Dimethyl-2-phenylmorpholine hydrochloride,
2126178-41-2,
|
| Complexity | 177 |
| 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 | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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