丙呋甲酮
TL;DR: 丙呋甲酮 (CAS 4976-25-4) is a chemical compound with molecular formula C13H14O2 and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙呋甲酮
1-[(2R)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]ethanone
Also Known As: Tremetone, Tremeton, (-)-Tremetone, Obidoxime perchlorate, TREMETONE [MI]
| Molecular Formula | C13H14O2 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.09938 |
| Heavy Atoms | 15 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 4976-25-4 |
|---|---|
| SMILES | CC(=C)[C@H]1CC2=C(O1)C=CC(=C2)C(=O)C |
| InChIKey | UVYUUQGGBNKRFU-CYBMUJFWSA-N |
Product Overview
丙呋甲酮 (CAS 4976-25-4), with molecular formula C13H14O2 and molecular weight 202.10 g/mol. IUPAC: 1-[(2R)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]ethanone.
Chemical Property Profile of 丙呋甲酮
Property Insights of 丙呋甲酮
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丙呋甲酮. With a topological polar surface area (TPSA) of 26.3 Ų, 丙呋甲酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙呋甲酮 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 丙呋甲酮?
The CAS number of 丙呋甲酮 is 4976-25-4.
What is the molecular formula of 丙呋甲酮?
The molecular formula of 丙呋甲酮 is C13H14O2.
What is the molecular weight of 丙呋甲酮?
The molecular weight of 丙呋甲酮 is 202.10 g/mol.
Where can I buy 丙呋甲酮?
You can request a quote for 丙呋甲酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙呋甲酮?
Yes, KEHONG BIO provides custom synthesis services for 丙呋甲酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.