| CAS Number | 97630-97-2 |
| Catalog Number | AG003LBO(AGN-PC-00MNEM) |
| Chemical Name | 4-ETHYL-2-HYDROXY-3-METHYL-2-PHENYLMORPHOLINE HCL |
| IUPAC Name | 4-ethyl-3-methyl-2-phenylmorpholin-2-ol;hydrochloride |
| InChI | InChI=1S/C13H19NO2.ClH/c1-3-14-9-10-16-13(15,11(14)2)12-7-5-4-6-8-12;/h4-8,11,15H,3,9-10H2,1-2H3;1H |
| InChI Key | QJHFPCKHDMBFLK-UHFFFAOYSA-N |
| MDL Number | MFCD30145917 |
| Molecular Formula | C13H20ClNO2 |
| Molecular Weight | 257.7564 |
| SMILES | OC1(C2=CC=CC=C2)C(C)N(CC)CCO1.[H]Cl |
| Synonyms | 97630-97-2,
4-ethyl-2-hydroxy-3-methyl-2-phenylmorpholine HCl,
4-Ethyl-3-methyl-2-phenylmorpholin-2-ol hydrochloride,
2-Morpholinol, 4-ethyl-3-methyl-2-phenyl-, hydrochloride,
SCHEMBL10647522,
MFCD30145917,
AKOS028109858,
KS-000002C1,
2-Morpholinol,4-ethyl-3-methyl-2-phenyl-,hydrochloride,
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| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.758g/mol |
| Monoisotopic Mass | 257.118g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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