5,5-Dimethyl-2-phenylmorpholine
TL;DR: 5,5-Dimethyl-2-phenylmorpholine (CAS 42013-48-9) 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.
5,5-dimethyl-2-phenylmorpholine
Also Known As: 5,5-Dimethyl-2-phenylmorpholine, 5,5-DIMETHYL-2-PHENYL-MORPHOLINE, Morpholine, 5,5-dimethyl-2-phenyl-, 2-phenyl-5,5-dimethylmorpholine, 2-phenyl-5,5-dimethyltetrahydro-1,4-oxazine
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 42013-48-9 |
|---|---|
| SMILES | CC1(COC(CN1)C2=CC=CC=C2)C |
| InChIKey | KJUOROGOOZJYAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,5-Dimethyl-2-phenylmorpholine (CAS 42013-48-9), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: 5,5-dimethyl-2-phenylmorpholine.
Chemical Property Profile of 5,5-Dimethyl-2-phenylmorpholine
Property Insights of 5,5-Dimethyl-2-phenylmorpholine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dimethyl-2-phenylmorpholine. With a topological polar surface area (TPSA) of 21.3 Ų, 5,5-Dimethyl-2-phenylmorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-2-phenylmorpholine 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 5,5-Dimethyl-2-phenylmorpholine?
The CAS number of 5,5-Dimethyl-2-phenylmorpholine is 42013-48-9.
What is the molecular formula of 5,5-Dimethyl-2-phenylmorpholine?
The molecular formula of 5,5-Dimethyl-2-phenylmorpholine is C12H17NO.
What is the molecular weight of 5,5-Dimethyl-2-phenylmorpholine?
The molecular weight of 5,5-Dimethyl-2-phenylmorpholine is 191.13 g/mol.
Where can I buy 5,5-Dimethyl-2-phenylmorpholine?
You can request a quote for 5,5-Dimethyl-2-phenylmorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-2-phenylmorpholine?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-2-phenylmorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.