| CAS Number | 915921-63-0 |
| Catalog Number | AG00GTPY(AGN-PC-0WB3HN) |
| Chemical Name | 3-(2-(Piperidin-2-yl)ethyl)phenol |
| IUPAC Name | 3-(2-piperidin-2-ylethyl)phenol |
| InChI | InChI=1S/C13H19NO/c15-13-6-3-4-11(10-13)7-8-12-5-1-2-9-14-12/h3-4,6,10,12,14-15H,1-2,5,7-9H2 |
| InChI Key | QFJBYDKJQKTNMS-UHFFFAOYSA-N |
| MDL Number | MFCD08059831 |
| Molecular Formula | C13H19NO |
| Molecular Weight | 205.2961 |
| SMILES | N1C(CCCC1)CCC=1C=C(C=CC1)O |
| Synonyms | 3-(2-Piperidin-2-ylethyl)phenol,
915921-63-0,
CHEMBRDG-BB 4011370,
DTXSID50655569,
ZX-CM003708,
3-[2-(2-Piperidinyl)ethyl]phenol,
MFCD08059831,
3-[2-(Piperidin-2-yl)ethyl]phenol,
AKOS009322707,
DA-18855,
FT-0708106,
3-(2-Piperidin-2-ylethyl)phenol, AldrichCPR,
Y-3408,
4011370-25G,
4011370-50G,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.301g/mol |
| Monoisotopic Mass | 205.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number