3-Butoxybenzaldehyde
TL;DR: 3-Butoxybenzaldehyde (CAS 30609-20-2) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butoxybenzaldehyde
Also Known As: 3-butoxybenzaldehyde, 3-butoxy-benzaldehyde, 3-n-butoxybenzaldehyde, m-Butoxy-benzaldehyd, 3-Butyloxybenzaldehyde
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.678 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 268.54773 |
Chemical Identifiers
| CAS Number | 30609-20-2 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C=O |
Product Overview
3-Butoxybenzaldehyde (CAS 30609-20-2), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 3-butoxybenzaldehyde.
Chemical Property Profile of 3-Butoxybenzaldehyde
Property Insights of 3-Butoxybenzaldehyde
The XLogP value of 2.678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Butoxybenzaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Butoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butoxybenzaldehyde 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 3-Butoxybenzaldehyde?
The CAS number of 3-Butoxybenzaldehyde is 30609-20-2.
What is the molecular formula of 3-Butoxybenzaldehyde?
The molecular formula of 3-Butoxybenzaldehyde is C11H14O2.
What is the molecular weight of 3-Butoxybenzaldehyde?
The molecular weight of 3-Butoxybenzaldehyde is 178.10 g/mol.
Where can I buy 3-Butoxybenzaldehyde?
You can request a quote for 3-Butoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Butoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.