5-(4-Methylphenyl)heptanal
TL;DR: 5-(4-Methylphenyl)heptanal (CAS 94201-03-3) is a chemical compound with molecular formula C14H20O and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylphenyl)heptanal
Also Known As: 5-(4-Methylphenyl)heptanal, 5- heptanal, EINECS 303-584-8, delta-Ethyl-4-methylbenzenepentanal
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 3.85782 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 286.71194 |
Chemical Identifiers
| CAS Number | 94201-03-3 |
|---|---|
| SMILES | CCC(CCCC=O)C1=CC=C(C=C1)C |
Product Overview
5-(4-Methylphenyl)heptanal (CAS 94201-03-3), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 5-(4-methylphenyl)heptanal.
Chemical Property Profile of 5-(4-Methylphenyl)heptanal
Property Insights of 5-(4-Methylphenyl)heptanal
The XLogP value of 3.85782 indicates that 5-(4-Methylphenyl)heptanal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 5-(4-Methylphenyl)heptanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Methylphenyl)heptanal 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 5-(4-Methylphenyl)heptanal?
The CAS number of 5-(4-Methylphenyl)heptanal is 94201-03-3.
What is the molecular formula of 5-(4-Methylphenyl)heptanal?
The molecular formula of 5-(4-Methylphenyl)heptanal is C14H20O.
What is the molecular weight of 5-(4-Methylphenyl)heptanal?
The molecular weight of 5-(4-Methylphenyl)heptanal is 204.15 g/mol.
Where can I buy 5-(4-Methylphenyl)heptanal?
You can request a quote for 5-(4-Methylphenyl)heptanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Methylphenyl)heptanal?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Methylphenyl)heptanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.