| CAS Number | 878167-03-4 |
| Catalog Number | AG019TPU |
| Chemical Name | (1-benzyl-4-methylpiperidin-4-yl)methanol |
| IUPAC Name | (1-benzyl-4-methylpiperidin-4-yl)methanol |
| InChI | InChI=1S/C14H21NO/c1-14(12-16)7-9-15(10-8-14)11-13-5-3-2-4-6-13/h2-6,16H,7-12H2,1H3 |
| InChI Key | PXRXXAWVTCEAMW-UHFFFAOYSA-N |
| MDL Number | MFCD18157617 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.3226 |
| SMILES | C(C1=CC=CC=C1)N1CCC(CC1)(C)CO |
| Synonyms | (1-benzyl-4-methylpiperidin-4-yl)methanol,
878167-03-4,
1-Benzyl-4-methyl-4-piperidinemethanol,
SCHEMBL1269135,
PXRXXAWVTCEAMW-UHFFFAOYSA-N,
ZINC72266627,
W-4812,
4-Piperidinemethanol, 4-methyl-1-(phenylmethyl)-,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.162g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.328g/mol |
| Monoisotopic Mass | 219.162g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number