Bontril
TL;DR: Bontril (CAS 21784-30-5) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-2-phenylmorpholine
Also Known As: phendimetrazine, Bontril, Antapentan, hyrex, Mephenmetrazine
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
| Melting Point | 134.5 °C |
| Solubility | 2.43e+00 g/L |
Chemical Identifiers
| CAS Number | 21784-30-5 |
|---|---|
| SMILES | CC1C(OCCN1C)C2=CC=CC=C2 |
| InChIKey | MFOCDFTXLCYLKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bontril (CAS 21784-30-5), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: 3,4-dimethyl-2-phenylmorpholine.
Chemical Property Profile of Bontril
Property Insights of Bontril
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bontril. With a topological polar surface area (TPSA) of 12.5 Ų, Bontril exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bontril has 0 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 Bontril?
The CAS number of Bontril is 21784-30-5.
What is the molecular formula of Bontril?
The molecular formula of Bontril is C12H17NO.
What is the molecular weight of Bontril?
The molecular weight of Bontril is 191.13 g/mol.
Where can I buy Bontril?
You can request a quote for Bontril directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bontril?
Yes, KEHONG BIO provides custom synthesis services for Bontril and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.