3-Propoxybenzaldehyde
TL;DR: 3-Propoxybenzaldehyde (CAS 67698-61-7) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propoxybenzaldehyde
Also Known As: 3-propoxybenzaldehyde, Benzaldehyde, 3-propoxy-, 3-n-Propoxybenzaldehyde, 3-propoxy-benzaldehyde, 3-propyloxybenzaldehyde
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 2.2879 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 255.77042 |
Chemical Identifiers
| CAS Number | 67698-61-7 |
|---|---|
| SMILES | CCCOC1=CC=CC(=C1)C=O |
Product Overview
3-Propoxybenzaldehyde (CAS 67698-61-7), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 3-propoxybenzaldehyde.
Chemical Property Profile of 3-Propoxybenzaldehyde
Property Insights of 3-Propoxybenzaldehyde
The XLogP value of 2.2879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Propoxybenzaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Propoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Propoxybenzaldehyde 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-Propoxybenzaldehyde?
The CAS number of 3-Propoxybenzaldehyde is 67698-61-7.
What is the molecular formula of 3-Propoxybenzaldehyde?
The molecular formula of 3-Propoxybenzaldehyde is C10H12O2.
What is the molecular weight of 3-Propoxybenzaldehyde?
The molecular weight of 3-Propoxybenzaldehyde is 164.08 g/mol.
Where can I buy 3-Propoxybenzaldehyde?
You can request a quote for 3-Propoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Propoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Propoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.