4-Butylbenzaldehyde
TL;DR: 4-Butylbenzaldehyde (CAS 1200-14-2) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butylbenzaldehyde
Also Known As: 4-Butylbenzaldehyde, Benzaldehyde, 4-butyl-, p-Butylbenzaldehyde, 4-N-BUTYLBENZALDEHYDE, butylbenzaldehyde
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 1200-14-2 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)C=O |
| InChIKey | ARIREUPIXAKDAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Butylbenzaldehyde (CAS 1200-14-2), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 4-butylbenzaldehyde.
Chemical Property Profile of 4-Butylbenzaldehyde
Property Insights of 4-Butylbenzaldehyde
The XLogP value of 3.2 indicates that 4-Butylbenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Butylbenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butylbenzaldehyde 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-Butylbenzaldehyde?
The CAS number of 4-Butylbenzaldehyde is 1200-14-2.
What is the molecular formula of 4-Butylbenzaldehyde?
The molecular formula of 4-Butylbenzaldehyde is C11H14O.
What is the molecular weight of 4-Butylbenzaldehyde?
The molecular weight of 4-Butylbenzaldehyde is 162.10 g/mol.
Where can I buy 4-Butylbenzaldehyde?
You can request a quote for 4-Butylbenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butylbenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Butylbenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.