| CAS Number | 1461707-61-8 |
| Catalog Number | AG019L7P |
| Chemical Name | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine hydrochloride |
| IUPAC Name | 2,3-dihydro-1,4-benzodioxin-6-yl(piperidin-4-yl)methanone;hydrochloride |
| InChI | InChI=1S/C14H17NO3.ClH/c16-14(10-3-5-15-6-4-10)11-1-2-12-13(9-11)18-8-7-17-12;/h1-2,9-10,15H,3-8H2;1H |
| InChI Key | XKBQNWCBQHATEY-UHFFFAOYSA-N |
| MDL Number | MFCD28118286 |
| Molecular Formula | C14H18ClNO3 |
| Molecular Weight | 283.7506 |
| SMILES | Cl.O=C(C1=CC2=C(OCCO2)C=C1)C1CCNCC1 |
| Synonyms | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidine hydrochloride,
1461707-61-8,
NE59992,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.752g/mol |
| Monoisotopic Mass | 283.098g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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