3-(Butoxymethyl)-4-methoxybenzaldehyde
TL;DR: 3-(Butoxymethyl)-4-methoxybenzaldehyde (CAS 893733-37-4) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(butoxymethyl)-4-methoxybenzaldehyde
Also Known As: 3-(butoxymethyl)-4-methoxybenzaldehyde, 3-(butoxymethyl)-4-methoxy-benzaldehyde, Benzaldehyde, 3-(butoxymethyl)-4-methoxy-
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 2.8244 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 333.94965 |
Chemical Identifiers
| CAS Number | 893733-37-4 |
|---|---|
| SMILES | CCCCOCC1=C(C=CC(=C1)C=O)OC |
Product Overview
3-(Butoxymethyl)-4-methoxybenzaldehyde (CAS 893733-37-4), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 3-(butoxymethyl)-4-methoxybenzaldehyde.
Chemical Property Profile of 3-(Butoxymethyl)-4-methoxybenzaldehyde
Property Insights of 3-(Butoxymethyl)-4-methoxybenzaldehyde
The XLogP value of 2.8244 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Butoxymethyl)-4-methoxybenzaldehyde. With a topological polar surface area (TPSA) of 35.53 Ų, 3-(Butoxymethyl)-4-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Butoxymethyl)-4-methoxybenzaldehyde has 0 hydrogen bond donor(s) and 3 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-(Butoxymethyl)-4-methoxybenzaldehyde?
The CAS number of 3-(Butoxymethyl)-4-methoxybenzaldehyde is 893733-37-4.
What is the molecular formula of 3-(Butoxymethyl)-4-methoxybenzaldehyde?
The molecular formula of 3-(Butoxymethyl)-4-methoxybenzaldehyde is C13H18O3.
What is the molecular weight of 3-(Butoxymethyl)-4-methoxybenzaldehyde?
The molecular weight of 3-(Butoxymethyl)-4-methoxybenzaldehyde is 222.13 g/mol.
Where can I buy 3-(Butoxymethyl)-4-methoxybenzaldehyde?
You can request a quote for 3-(Butoxymethyl)-4-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Butoxymethyl)-4-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(Butoxymethyl)-4-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.