2-Propenal, 3-(3-methoxyphenyl)-, (2E)-
TL;DR: 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- (CAS 39677-52-6) 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.
3-(3-methoxyphenyl)prop-2-enal
Also Known As: 3-Methoxycinnamaldehyde, 3-(3-METHOXYPHENYL)PROP-2-ENAL, (E)-3-(3-Methoxyphenyl)acrylaldehyde, 3-(3-methoxyphenyl)acrylaldehyde, 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.0 |
| 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 | 163.0 |
Chemical Identifiers
| CAS Number | 39677-52-6 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C=CC=O |
| InChIKey | XHYAQFCRAQUBTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenal, 3-(3-methoxyphenyl)-, (2E)- (CAS 39677-52-6), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: 3-(3-methoxyphenyl)prop-2-enal.
Chemical Property Profile of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-
Property Insights of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- 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 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-?
The CAS number of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- is 39677-52-6.
What is the molecular formula of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-?
The molecular formula of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- is C10H10O2.
What is the molecular weight of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-?
The molecular weight of 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- is 162.07 g/mol.
Where can I buy 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-?
You can request a quote for 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenal, 3-(3-methoxyphenyl)-, (2E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenal, 3-(3-methoxyphenyl)-, (2E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.