4-戊氧基苯甲醛
TL;DR: 4-戊氧基苯甲醛 (CAS 5736-91-4) is a chemical compound with molecular formula C12H16O2 and molecular weight 192.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-戊氧基苯甲醛
4-pentoxybenzaldehyde
Also Known As: 4-(Pentyloxy)benzaldehyde, 4-Pentoxybenzaldehyde, 4-Amyloxybenzaldehyde, p-Pentyloxybenzaldehyde, 4-n-Pentyloxybenzaldehyde
| Molecular Formula | C12H16O2 |
|---|---|
| Molecular Weight | 192.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 192.11504 |
| Heavy Atoms | 14 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 5736-91-4 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)C=O |
| InChIKey | YAPVGSXODFOBBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-戊氧基苯甲醛 (CAS 5736-91-4), with molecular formula C12H16O2 and molecular weight 192.12 g/mol. IUPAC: 4-pentoxybenzaldehyde.
Chemical Property Profile of 4-戊氧基苯甲醛
Property Insights of 4-戊氧基苯甲醛
The XLogP value of 3.3 indicates that 对戊氧基苯甲醛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-戊氧基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对戊氧基苯甲醛 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 对戊氧基苯甲醛?
The CAS number of 对戊氧基苯甲醛 is 5736-91-4.
What is the molecular formula of 对戊氧基苯甲醛?
The molecular formula of 对戊氧基苯甲醛 is C12H16O2.
What is the molecular weight of 对戊氧基苯甲醛?
The molecular weight of 对戊氧基苯甲醛 is 192.12 g/mol.
Where can I buy 对戊氧基苯甲醛?
You can request a quote for 对戊氧基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对戊氧基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 对戊氧基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.