肉豆蔻醚
TL;DR: 肉豆蔻醚 (CAS 607-91-0) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
肉豆蔻醚
4-methoxy-6-prop-2-enyl-1,3-benzodioxole
Also Known As: Myristicin, Myristicine, Elemicin, Myristicin_major, Myristicin (6CI)
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
| Melting Point | <-20 °C |
| Boiling Point | 276.5 °C |
| Density | 1.1416 at 20 °C g/cu cm |
| Solubility | Insoluble in water, slightly soluble in ethanol, soluble in ether and benzene. |
| Vapor Pressure | 0.00646 [mmHg] |
| Refractive Index | = 1.5403 at 20 °C |
Chemical Identifiers
| CAS Number | 607-91-0 |
|---|---|
| SMILES | COC1=CC(=CC2=C1OCO2)CC=C |
| InChIKey | BNWJOHGLIBDBOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
肉豆蔻醚 (CAS 607-91-0), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 4-methoxy-6-prop-2-enyl-1,3-benzodioxole.
Chemical Property Profile of 肉豆蔻醚
Property Insights of 肉豆蔻醚
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 肉豆蔻醚. With a topological polar surface area (TPSA) of 27.7 Ų, 肉豆蔻醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 肉豆蔻醚 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 肉豆蔻醚?
The CAS number of 肉豆蔻醚 is 607-91-0.
What is the molecular formula of 肉豆蔻醚?
The molecular formula of 肉豆蔻醚 is C11H12O3.
What is the molecular weight of 肉豆蔻醚?
The molecular weight of 肉豆蔻醚 is 192.08 g/mol.
Where can I buy 肉豆蔻醚?
You can request a quote for 肉豆蔻醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 肉豆蔻醚?
Yes, KEHONG BIO provides custom synthesis services for 肉豆蔻醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.