2-((4-Methylphenyl)methylene)heptan-1-al
TL;DR: 2-((4-Methylphenyl)methylene)heptan-1-al (CAS 154581-97-2) is a chemical compound with molecular formula C15H20O and molecular weight 216.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(4-methylphenyl)methylidene]heptanal
Also Known As: EINECS 283-718-9, 2-((4-Methylphenyl)methylene)heptan-1-al, p-Methyl-a-amyl cinnamic aldehyde, 2-[(4-Methylphenyl)methylene]heptanal, Heptanal, 2-((4-methylphenyl)methylene)-
| Molecular Formula | C15H20O |
|---|---|
| Molecular Weight | 216.15 g/mol |
| LogP | 4.15762 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 216.15141 |
| Heavy Atoms | 16 |
| Complexity | 346.20264 |
Chemical Identifiers
| CAS Number | 154581-97-2 |
|---|---|
| SMILES | CCCCC/C(=C\C1=CC=C(C=C1)C)/C=O |
Product Overview
2-((4-Methylphenyl)methylene)heptan-1-al (CAS 154581-97-2), with molecular formula C15H20O and molecular weight 216.15 g/mol. IUPAC: (2E)-2-[(4-methylphenyl)methylidene]heptanal.
Chemical Property Profile of 2-((4-Methylphenyl)methylene)heptan-1-al
Property Insights of 2-((4-Methylphenyl)methylene)heptan-1-al
The XLogP value of 4.15762 indicates that 2-((4-Methylphenyl)methylene)heptan-1-al is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-((4-Methylphenyl)methylene)heptan-1-al exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Methylphenyl)methylene)heptan-1-al 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 2-((4-Methylphenyl)methylene)heptan-1-al?
The CAS number of 2-((4-Methylphenyl)methylene)heptan-1-al is 154581-97-2.
What is the molecular formula of 2-((4-Methylphenyl)methylene)heptan-1-al?
The molecular formula of 2-((4-Methylphenyl)methylene)heptan-1-al is C15H20O.
What is the molecular weight of 2-((4-Methylphenyl)methylene)heptan-1-al?
The molecular weight of 2-((4-Methylphenyl)methylene)heptan-1-al is 216.15 g/mol.
Where can I buy 2-((4-Methylphenyl)methylene)heptan-1-al?
You can request a quote for 2-((4-Methylphenyl)methylene)heptan-1-al directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Methylphenyl)methylene)heptan-1-al?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Methylphenyl)methylene)heptan-1-al and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.