| CAS Number | 79557-03-2 |
| Catalog Number | AG00G4YK(AGN-PC-00DUUW) |
| Chemical Name | 1-(4-Hydroxyphenyl)piperidin-2-one |
| IUPAC Name | 1-(4-hydroxyphenyl)piperidin-2-one |
| InChI | InChI=1S/C11H13NO2/c13-10-6-4-9(5-7-10)12-8-2-1-3-11(12)14/h4-7,13H,1-3,8H2 |
| InChI Key | PUGFQIKPJUHWEV-UHFFFAOYSA-N |
| MDL Number | MFCD20260846 |
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.2264 |
| SMILES | OC1=CC=C(N2C(=O)CCCC2)C=C1 |
| Synonyms | 1-(4-hydroxyphenyl)piperidin-2-one,
79557-03-2,
1-(4-Hydroxyphenyl)-2-piperidinone,
SCHEMBL2644969,
CTK7J9393,
DTXSID20470382,
ZINC22061067,
1-(4-Hydroxyphenyl)piperidine-2-one,
AKOS006329025,
2-Piperidinone, 1-(4-hydroxyphenyl)-,
DA-03242,
FT-0669991,
CID11672829,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.23g/mol |
| Monoisotopic Mass | 191.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number