1,2,3,4-四氢菲-1-酮
TL;DR: 1,2,3,4-四氢菲-1-酮 (CAS 573-22-8) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-四氢菲-1-酮
(E)-3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)prop-2-enal
Also Known As: 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)prop-2-enal, 2-Propenal, 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-, 3-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]heptane-1-yl)propenal, 3-{2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl}prop-2-enal, (2E)-3-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-2-propenal #
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.4793 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 292.69687 |
Chemical Identifiers
| CAS Number | 573-22-8 |
|---|---|
| SMILES | CC1(CCCC2(C1(O2)/C=C/C=O)C)C |
Product Overview
1,2,3,4-四氢菲-1-酮 (CAS 573-22-8), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: (E)-3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)prop-2-enal.
Chemical Property Profile of 1,2,3,4-四氢菲-1-酮
Property Insights of 1,2,3,4-四氢菲-1-酮
The XLogP value of 2.4793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-四氢菲-1-酮. With a topological polar surface area (TPSA) of 29.6 Ų, 1,2,3,4-四氢菲-1-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-四氢菲-1-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 1,2,3,4-四氢菲-1-酮?
The CAS number of 1,2,3,4-四氢菲-1-酮 is 573-22-8.
What is the molecular formula of 1,2,3,4-四氢菲-1-酮?
The molecular formula of 1,2,3,4-四氢菲-1-酮 is C12H18O2.
What is the molecular weight of 1,2,3,4-四氢菲-1-酮?
The molecular weight of 1,2,3,4-四氢菲-1-酮 is 194.13 g/mol.
Where can I buy 1,2,3,4-四氢菲-1-酮?
You can request a quote for 1,2,3,4-四氢菲-1-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-四氢菲-1-酮?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-四氢菲-1-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.