| CAS Number | 1315365-35-5 |
| Catalog Number | AG01AJE3 |
| Chemical Name | 4-(2-ethoxyphenyl)-1,2,3,6-tetrahydropyridine hydrochloride |
| IUPAC Name | 4-(2-ethoxyphenyl)-1,2,3,6-tetrahydropyridine;hydrochloride |
| InChI | InChI=1S/C13H17NO.ClH/c1-2-15-13-6-4-3-5-12(13)11-7-9-14-10-8-11;/h3-7,14H,2,8-10H2,1H3;1H |
| InChI Key | DLHFOAXBOQXBIV-UHFFFAOYSA-N |
| MDL Number | MFCD19382246 |
| Molecular Formula | C13H18ClNO |
| Molecular Weight | 239.7411 |
| SMILES | Cl.CCOC1=C(C2CCNCC=2)C=CC=C1 |
| Synonyms | 4-(2-ethoxyphenyl)-1,2,3,6-tetrahydropyridine hydrochloride,
1315365-35-5,
MCULE-2542390667,
NE47215,
EN300-80484,
Z1270210794,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.743g/mol |
| Monoisotopic Mass | 239.108g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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