| CAS Number | 1159826-57-9 |
| Catalog Number | AG000HCN(AGN-PC-0WCXY6) |
| Chemical Name | 2-Ethyl-piperidin-3-one, HCl |
| IUPAC Name | 2-ethylpiperidin-3-one;hydrochloride |
| InChI | InChI=1S/C7H13NO.ClH/c1-2-6-7(9)4-3-5-8-6;/h6,8H,2-5H2,1H3;1H |
| InChI Key | RKYYSPXEELHYRU-UHFFFAOYSA-N |
| MDL Number | MFCD08061213 |
| Molecular Formula | C7H14ClNO |
| Molecular Weight | 163.6452 |
| SMILES | Cl.CCC1NCCCC1=O |
| Synonyms | 1159826-57-9,
2-ethylpiperidin-3-one hydrochloride,
2-Ethyl-piperidin-3-one hydrochloride,
2-ETHYL-PIPERIDIN-3-ONE HCL,
2-Ethyl-piperidin-3-one, HCl,
CTK6D2742,
DTXSID90661341,
MFCD08061213,
AKOS006285220,
AB43253,
AS-37996,
AB0076624,
AX8266880,
X-3706,
3-Piperidinone, 2-ethyl-, hydrochloride (1:1),
2-Ethylpiperidin-3-one--hydrogen chloride (1/1),
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| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.645g/mol |
| Monoisotopic Mass | 163.076g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number