| CAS Number | 1171849-90-3 |
| Catalog Number | AG008SLX(AGN-PC-0WQXEA) |
| Chemical Name | 4-Piperidin-4-ylmethyl-phenol hydrochloride |
| IUPAC Name | 4-(piperidin-4-ylmethyl)phenol;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c14-12-3-1-10(2-4-12)9-11-5-7-13-8-6-11;/h1-4,11,13-14H,5-9H2;1H |
| InChI Key | IMFFPSRYOCGSDG-UHFFFAOYSA-N |
| MDL Number | MFCD08437509 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | Cl.N1CCC(CC1)CC1=CC=C(C=C1)O |
| Synonyms | 4-Piperidin-4-ylmethyl-phenol hydrochloride,
1171849-90-3,
SCHEMBL1006327,
DTXSID90588781,
IMFFPSRYOCGSDG-UHFFFAOYSA-N,
BP014,
MFCD08437509,
AB45044,
OR307720,
4-Piperidin-4-ylmethylphenol hydrochloride,
4-(Piperidin-4-ylmethyl)phenol hydrochloride,
T6211,
4-[(Piperidin-4-yl)methyl]phenol--hydrogen chloride (1/1),
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| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.732g/mol |
| Monoisotopic Mass | 227.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number