4,5-Dihydro-2-propyloxazole
TL;DR: 4,5-Dihydro-2-propyloxazole (CAS 4694-80-8) is a chemical compound with molecular formula C6H11NO and molecular weight 113.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propyl-4,5-dihydro-1,3-oxazole
Also Known As: 2-Propyl-2-oxazoline, 4,5-Dihydro-2-propyloxazole, 2-propyl-4,5-dihydro-1,3-oxazole, 2-Propyl-4,5-dihydrooxazole, 2-n-propyl-2-oxazoline
| Molecular Formula | C6H11NO |
|---|---|
| Molecular Weight | 113.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 113.08406 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 4694-80-8 |
|---|---|
| SMILES | CCCC1=NCCO1 |
| InChIKey | GXCJLVVUIVSLOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dihydro-2-propyloxazole (CAS 4694-80-8), with molecular formula C6H11NO and molecular weight 113.08 g/mol. IUPAC: 2-propyl-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of 4,5-Dihydro-2-propyloxazole
Property Insights of 4,5-Dihydro-2-propyloxazole
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dihydro-2-propyloxazole. With a topological polar surface area (TPSA) of 21.6 Ų, 4,5-Dihydro-2-propyloxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dihydro-2-propyloxazole 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 4,5-Dihydro-2-propyloxazole?
The CAS number of 4,5-Dihydro-2-propyloxazole is 4694-80-8.
What is the molecular formula of 4,5-Dihydro-2-propyloxazole?
The molecular formula of 4,5-Dihydro-2-propyloxazole is C6H11NO.
What is the molecular weight of 4,5-Dihydro-2-propyloxazole?
The molecular weight of 4,5-Dihydro-2-propyloxazole is 113.08 g/mol.
Where can I buy 4,5-Dihydro-2-propyloxazole?
You can request a quote for 4,5-Dihydro-2-propyloxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dihydro-2-propyloxazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dihydro-2-propyloxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.