5-Allyldihydro-1,3,5-dioxazine
TL;DR: 5-Allyldihydro-1,3,5-dioxazine (CAS 16574-19-9) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-prop-2-enyl-1,3,5-dioxazinane
Also Known As: 5-Allyldihydro-1,3,5-dioxazine, 5-Allyl-1,3,5-dioxazinane #, N-Allyl-dihydro1,3,5-dioxazine, 5-allyl-1,3-dioxa-5-azacyclohexane, 5-prop-2-enyl-1,3,5-dioxazinane
| Molecular Formula | C6H11NO2 |
|---|---|
| Molecular Weight | 129.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 129.07898 |
| Heavy Atoms | 9 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 16574-19-9 |
|---|---|
| SMILES | C=CCN1COCOC1 |
| InChIKey | MLRHSWJZGOGKSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Allyldihydro-1,3,5-dioxazine (CAS 16574-19-9), with molecular formula C6H11NO2 and molecular weight 129.08 g/mol. IUPAC: 5-prop-2-enyl-1,3,5-dioxazinane.
Chemical Property Profile of 5-Allyldihydro-1,3,5-dioxazine
Property Insights of 5-Allyldihydro-1,3,5-dioxazine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Allyldihydro-1,3,5-dioxazine. With a topological polar surface area (TPSA) of 21.7 Ų, 5-Allyldihydro-1,3,5-dioxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Allyldihydro-1,3,5-dioxazine has 0 hydrogen bond donor(s) and 3 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-Allyldihydro-1,3,5-dioxazine?
The CAS number of 5-Allyldihydro-1,3,5-dioxazine is 16574-19-9.
What is the molecular formula of 5-Allyldihydro-1,3,5-dioxazine?
The molecular formula of 5-Allyldihydro-1,3,5-dioxazine is C6H11NO2.
What is the molecular weight of 5-Allyldihydro-1,3,5-dioxazine?
The molecular weight of 5-Allyldihydro-1,3,5-dioxazine is 129.08 g/mol.
Where can I buy 5-Allyldihydro-1,3,5-dioxazine?
You can request a quote for 5-Allyldihydro-1,3,5-dioxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Allyldihydro-1,3,5-dioxazine?
Yes, KEHONG BIO provides custom synthesis services for 5-Allyldihydro-1,3,5-dioxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.