Phenol, 3,5-dimethyl-2-(piperidinomethyl)-
TL;DR: Phenol, 3,5-dimethyl-2-(piperidinomethyl)- (CAS 68097-90-5) is a chemical compound with molecular formula C14H21NO and molecular weight 219.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-2-(piperidin-1-ylmethyl)phenol
Also Known As: Ro 3-0590, Phenol, 3,5-dimethyl-2-(piperidinomethyl)-, 3,5-Dimethyl-2-(piperidinomethyl)phenol, Phenol, 3,5-dimethyl-2-(1-piperidinylmethyl)-, 5-20-02-00213 (Beilstein Handbook Reference)
| Molecular Formula | C14H21NO |
|---|---|
| Molecular Weight | 219.16 g/mol |
| LogP | 2.99494 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.16231 |
| Heavy Atoms | 16 |
| Complexity | 343.99326 |
Chemical Identifiers
| CAS Number | 68097-90-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)O)CN2CCCCC2)C |
Product Overview
Phenol, 3,5-dimethyl-2-(piperidinomethyl)- (CAS 68097-90-5), with molecular formula C14H21NO and molecular weight 219.16 g/mol. IUPAC: 3,5-dimethyl-2-(piperidin-1-ylmethyl)phenol.
Chemical Property Profile of Phenol, 3,5-dimethyl-2-(piperidinomethyl)-
Property Insights of Phenol, 3,5-dimethyl-2-(piperidinomethyl)-
The XLogP value of 2.99494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 3,5-dimethyl-2-(piperidinomethyl)-. With a topological polar surface area (TPSA) of 23.47 Ų, Phenol, 3,5-dimethyl-2-(piperidinomethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3,5-dimethyl-2-(piperidinomethyl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 3,5-dimethyl-2-(piperidinomethyl)-?
The CAS number of Phenol, 3,5-dimethyl-2-(piperidinomethyl)- is 68097-90-5.
What is the molecular formula of Phenol, 3,5-dimethyl-2-(piperidinomethyl)-?
The molecular formula of Phenol, 3,5-dimethyl-2-(piperidinomethyl)- is C14H21NO.
What is the molecular weight of Phenol, 3,5-dimethyl-2-(piperidinomethyl)-?
The molecular weight of Phenol, 3,5-dimethyl-2-(piperidinomethyl)- is 219.16 g/mol.
Where can I buy Phenol, 3,5-dimethyl-2-(piperidinomethyl)-?
You can request a quote for Phenol, 3,5-dimethyl-2-(piperidinomethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 3,5-dimethyl-2-(piperidinomethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 3,5-dimethyl-2-(piperidinomethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.