3-(Diethylamino)phenol
TL;DR: 3-(Diethylamino)phenol (CAS 91-68-9) is a chemical compound with molecular formula C10H15NO and molecular weight 165.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)phenol
Also Known As: 3-(Diethylamino)phenol, 3-DIETHYLAMINOPHENOL, m-(Diethylamino)phenol, N,N-Diethyl-m-aminophenol, Phenol, 3-(diethylamino)-
| Molecular Formula | C10H15NO |
|---|---|
| Molecular Weight | 165.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.11537 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
| Melting Point | 149 to 77.8 °C |
| Boiling Point | 529 to 280.0 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 68.9 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 91-68-9 |
|---|---|
| SMILES | CCN(CC)C1=CC(=CC=C1)O |
| InChIKey | WAVOOWVINKGEHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Diethylamino)phenol (CAS 91-68-9), with molecular formula C10H15NO and molecular weight 165.12 g/mol. IUPAC: 3-(diethylamino)phenol.
Chemical Property Profile of 3-(Diethylamino)phenol
Property Insights of 3-(Diethylamino)phenol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Diethylamino)phenol. With a topological polar surface area (TPSA) of 23.5 Ų, 3-(Diethylamino)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Diethylamino)phenol 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 3-(Diethylamino)phenol?
The CAS number of 3-(Diethylamino)phenol is 91-68-9.
What is the molecular formula of 3-(Diethylamino)phenol?
The molecular formula of 3-(Diethylamino)phenol is C10H15NO.
What is the molecular weight of 3-(Diethylamino)phenol?
The molecular weight of 3-(Diethylamino)phenol is 165.12 g/mol.
Where can I buy 3-(Diethylamino)phenol?
You can request a quote for 3-(Diethylamino)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Diethylamino)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-(Diethylamino)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.