4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde
TL;DR: 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde (CAS 428479-97-4) is a chemical compound with molecular formula C11H11ClO3 and molecular weight 226.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-methoxy-4-prop-2-enoxybenzaldehyde
Also Known As: 4-(ALLYLOXY)-3-CHLORO-5-METHOXYBENZALDEHYDE, 3-chloro-5-methoxy-4-prop-2-enoxybenzaldehyde, 3-chloro-5-methoxy-4-(prop-2-en-1-yloxy)benzaldehyde, 4-Allyloxy-3-chloro-5-methoxy-benzaldehyde, 3-chloro-5-methoxy-4-prop-2-enyloxybenzaldehyde
| Molecular Formula | C11H11ClO3 |
|---|---|
| Molecular Weight | 226.04 g/mol |
| LogP | 2.7259 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.03967 |
| Heavy Atoms | 15 |
| Complexity | 374.34094 |
Chemical Identifiers
| CAS Number | 428479-97-4 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=O)Cl)OCC=C |
Product Overview
4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde (CAS 428479-97-4), with molecular formula C11H11ClO3 and molecular weight 226.04 g/mol. IUPAC: 3-chloro-5-methoxy-4-prop-2-enoxybenzaldehyde.
Chemical Property Profile of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde
Property Insights of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde
The XLogP value of 2.7259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde. With a topological polar surface area (TPSA) of 35.53 Ų, 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Allyloxy)-3-chloro-5-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 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde?
The CAS number of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde is 428479-97-4.
What is the molecular formula of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde?
The molecular formula of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde is C11H11ClO3.
What is the molecular weight of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde?
The molecular weight of 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde is 226.04 g/mol.
Where can I buy 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde?
You can request a quote for 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Allyloxy)-3-chloro-5-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.