2-Butoxy-5-chlorobenzaldehyde
TL;DR: 2-Butoxy-5-chlorobenzaldehyde (CAS 27590-76-7) is a chemical compound with molecular formula C11H13ClO2 and molecular weight 212.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxy-5-chlorobenzaldehyde
Also Known As: 2-butoxy-5-chlorobenzaldehyde, 2-n-Butoxy-5-chlorobenzaldehyde, 2-butoxy-5-chloro-benzaldehyde, RefChem:257969
| Molecular Formula | C11H13ClO2 |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 3.3314 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.06041 |
| Heavy Atoms | 14 |
| Complexity | 310.15588 |
Chemical Identifiers
| CAS Number | 27590-76-7 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)Cl)C=O |
Product Overview
2-Butoxy-5-chlorobenzaldehyde (CAS 27590-76-7), with molecular formula C11H13ClO2 and molecular weight 212.06 g/mol. IUPAC: 2-butoxy-5-chlorobenzaldehyde.
Chemical Property Profile of 2-Butoxy-5-chlorobenzaldehyde
Property Insights of 2-Butoxy-5-chlorobenzaldehyde
The XLogP value of 3.3314 indicates that 2-Butoxy-5-chlorobenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Butoxy-5-chlorobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butoxy-5-chlorobenzaldehyde 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 2-Butoxy-5-chlorobenzaldehyde?
The CAS number of 2-Butoxy-5-chlorobenzaldehyde is 27590-76-7.
What is the molecular formula of 2-Butoxy-5-chlorobenzaldehyde?
The molecular formula of 2-Butoxy-5-chlorobenzaldehyde is C11H13ClO2.
What is the molecular weight of 2-Butoxy-5-chlorobenzaldehyde?
The molecular weight of 2-Butoxy-5-chlorobenzaldehyde is 212.06 g/mol.
Where can I buy 2-Butoxy-5-chlorobenzaldehyde?
You can request a quote for 2-Butoxy-5-chlorobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butoxy-5-chlorobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Butoxy-5-chlorobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.