![2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal structure](/static/products/851/85136-04-5.png)
2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal
TL;DR: 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal (CAS 85136-04-5) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxyphenyl)methyl]-2-methylpent-3-enal
Also Known As: 2-[(4-methoxyphenyl)methyl]-2-methylpent-3-enal, 4-Methoxy-I+/--methyl-I+/--1-propen-1-ylbenzenepropanal
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | 3.019 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.13068 |
| Heavy Atoms | 16 |
| Complexity | 364.82666 |
Chemical Identifiers
| CAS Number | 85136-04-5 |
|---|---|
| SMILES | CC=CC(C)(CC1=CC=C(C=C1)OC)C=O |
Product Overview
2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal (CAS 85136-04-5), with molecular formula C14H18O2 and molecular weight 218.13 g/mol. IUPAC: 2-[(4-methoxyphenyl)methyl]-2-methylpent-3-enal.
Chemical Property Profile of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal
Property Insights of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal
The XLogP value of 3.019 indicates that 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal 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-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal?
The CAS number of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal is 85136-04-5.
What is the molecular formula of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal?
The molecular formula of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal is C14H18O2.
What is the molecular weight of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal?
The molecular weight of 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal is 218.13 g/mol.
Where can I buy 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal?
You can request a quote for 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Methoxyphenyl)methyl]-2-methylpent-3-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.