4-Isopropylcinnamaldehyde
TL;DR: 4-Isopropylcinnamaldehyde (CAS 6975-24-2) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-propan-2-ylphenyl)prop-2-enal
Also Known As: 4-ISOPROPYLCINNAMALDEHYDE, 2-phenylcyclobutanone, p-Isopropylcinnamaldehyde, 3-(4-Isopropylphenyl)acrylaldehyde, EINECS 230-230-9
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 3.0221 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 293.40546 |
Chemical Identifiers
| CAS Number | 6975-24-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)/C=C/C=O |
Product Overview
4-Isopropylcinnamaldehyde (CAS 6975-24-2), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: (E)-3-(4-propan-2-ylphenyl)prop-2-enal.
Chemical Property Profile of 4-Isopropylcinnamaldehyde
Property Insights of 4-Isopropylcinnamaldehyde
The XLogP value of 3.0221 indicates that 4-Isopropylcinnamaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Isopropylcinnamaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isopropylcinnamaldehyde has 0 hydrogen bond donor(s) and 1 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-Isopropylcinnamaldehyde?
The CAS number of 4-Isopropylcinnamaldehyde is 6975-24-2.
What is the molecular formula of 4-Isopropylcinnamaldehyde?
The molecular formula of 4-Isopropylcinnamaldehyde is C12H14O.
What is the molecular weight of 4-Isopropylcinnamaldehyde?
The molecular weight of 4-Isopropylcinnamaldehyde is 174.10 g/mol.
Where can I buy 4-Isopropylcinnamaldehyde?
You can request a quote for 4-Isopropylcinnamaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isopropylcinnamaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Isopropylcinnamaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.