4'-Methoxyacrylophenone
TL;DR: 4'-Methoxyacrylophenone (CAS 7448-86-4) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)prop-2-en-1-one
Also Known As: 4'-Methoxyacrylophenone, 1'-Oxoestragole, 1-(4-methoxyphenyl)prop-2-en-1-one, p-Methoxyacrylophenone, p-Methoxyphenyl vinyl ketone
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 7448-86-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C=C |
| InChIKey | YMESWDPSFKMFND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Methoxyacrylophenone (CAS 7448-86-4), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: 1-(4-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 4'-Methoxyacrylophenone
Property Insights of 4'-Methoxyacrylophenone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Methoxyacrylophenone. With a topological polar surface area (TPSA) of 26.3 Ų, 4'-Methoxyacrylophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Methoxyacrylophenone 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 4'-Methoxyacrylophenone?
The CAS number of 4'-Methoxyacrylophenone is 7448-86-4.
What is the molecular formula of 4'-Methoxyacrylophenone?
The molecular formula of 4'-Methoxyacrylophenone is C10H10O2.
What is the molecular weight of 4'-Methoxyacrylophenone?
The molecular weight of 4'-Methoxyacrylophenone is 162.07 g/mol.
Where can I buy 4'-Methoxyacrylophenone?
You can request a quote for 4'-Methoxyacrylophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Methoxyacrylophenone?
Yes, KEHONG BIO provides custom synthesis services for 4'-Methoxyacrylophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.