丁苯吗啉
TL;DR: 丁苯吗啉 (CAS 67564-91-4) is a chemical compound with molecular formula C20H33NO and molecular weight 303.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁苯吗啉
(2S,6R)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine
Also Known As: Fenpropimorph, Fenpropimorphe, Mistral, Corbel, Funbas
| Molecular Formula | C20H33NO |
|---|---|
| Molecular Weight | 303.26 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.25623 |
| Heavy Atoms | 22 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 67564-91-4 |
|---|---|
| SMILES | C[C@@H]1CN(C[C@@H](O1)C)CC(C)CC2=CC=C(C=C2)C(C)(C)C |
| InChIKey | RYAUSSKQMZRMAI-ALOPSCKCSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁苯吗啉 (CAS 67564-91-4), with molecular formula C20H33NO and molecular weight 303.26 g/mol. IUPAC: (2S,6R)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine.
Chemical Property Profile of 丁苯吗啉
Property Insights of 丁苯吗啉
The XLogP value of 5.2 indicates that 丁苯吗啉 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 丁苯吗啉 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁苯吗啉 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 丁苯吗啉?
The CAS number of 丁苯吗啉 is 67564-91-4.
What is the molecular formula of 丁苯吗啉?
The molecular formula of 丁苯吗啉 is C20H33NO.
What is the molecular weight of 丁苯吗啉?
The molecular weight of 丁苯吗啉 is 303.26 g/mol.
Where can I buy 丁苯吗啉?
You can request a quote for 丁苯吗啉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁苯吗啉?
Yes, KEHONG BIO provides custom synthesis services for 丁苯吗啉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.