玫瑰醚
TL;DR: 玫瑰醚 (CAS 16409-43-1) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
玫瑰醚
4-methyl-2-(2-methylprop-1-enyl)oxane
Also Known As: Rose oxide, Rosenoxide, Rosoxide, 4-Methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran, Rosenoxid
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 145.0 |
| Boiling Point | 86.00 °C. @ 20.00 mm Hg |
| Density | 0.873-0.877 |
| Solubility | 764 mg/L @ 20 °C (exp) |
| Refractive Index | 1.453-1.457 |
Chemical Identifiers
| CAS Number | 16409-43-1 |
|---|---|
| SMILES | CC1CCOC(C1)C=C(C)C |
| InChIKey | CZCBTSFUTPZVKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
玫瑰醚 (CAS 16409-43-1), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 4-methyl-2-(2-methylprop-1-enyl)oxane.
Chemical Property Profile of 玫瑰醚
Property Insights of 玫瑰醚
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 玫瑰醚. With a topological polar surface area (TPSA) of 9.2 Ų, 玫瑰醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 玫瑰醚 has 0 hydrogen bond donor(s) and 1 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 玫瑰醚?
The CAS number of 玫瑰醚 is 16409-43-1.
What is the molecular formula of 玫瑰醚?
The molecular formula of 玫瑰醚 is C10H18O.
What is the molecular weight of 玫瑰醚?
The molecular weight of 玫瑰醚 is 154.14 g/mol.
Where can I buy 玫瑰醚?
You can request a quote for 玫瑰醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 玫瑰醚?
Yes, KEHONG BIO provides custom synthesis services for 玫瑰醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.