3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
TL;DR: 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one (CAS 29808-43-3) is a chemical compound with molecular formula C13H14O3 and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
Also Known As: 3-(4-methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one, 1-(2-methyloxiran-2-yl)-3-(4-methoxyphenyl)-prop-2-en-1-one, RefChem:274691, CID 2795037
| Molecular Formula | C13H14O3 |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 2.0664 |
| Topological Polar Surface Area | 38.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.0943 |
| Heavy Atoms | 16 |
| Complexity | 413.30878 |
Chemical Identifiers
| CAS Number | 29808-43-3 |
|---|---|
| SMILES | CC1(CO1)C(=O)C=CC2=CC=C(C=C2)OC |
Product Overview
3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one (CAS 29808-43-3), with molecular formula C13H14O3 and molecular weight 218.09 g/mol. IUPAC: 3-(4-methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one.
Chemical Property Profile of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
Property Insights of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one
The XLogP value of 2.0664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one. With a topological polar surface area (TPSA) of 38.83 Ų, 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one 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 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The CAS number of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is 29808-43-3.
What is the molecular formula of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The molecular formula of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is C13H14O3.
What is the molecular weight of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
The molecular weight of 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one is 218.09 g/mol.
Where can I buy 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
You can request a quote for 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methoxyphenyl)-1-(2-methyloxiran-2-yl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.