2-Allyl-3-hydroxy-4-methoxybenzaldehyde
TL;DR: 2-Allyl-3-hydroxy-4-methoxybenzaldehyde (CAS 18075-41-7) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-methoxy-2-prop-2-enylbenzaldehyde
Also Known As: 2-Allyl-3-hydroxy-4-methoxybenzaldehyde, 2-allylisovanillin, 5-Methyl-6-allyl-guajacol, 3-hydroxy-4-methoxy-2-prop-2-enylbenzaldehyde, 2-allyl-3-hydroxy-4-methoxy-benzaldehyde
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 18075-41-7 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C=O)CC=C)O |
| InChIKey | JICUCNBJIIJEBA-UHFFFAOYSA-N |
Product Overview
2-Allyl-3-hydroxy-4-methoxybenzaldehyde (CAS 18075-41-7), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 3-hydroxy-4-methoxy-2-prop-2-enylbenzaldehyde.
Chemical Property Profile of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde
Property Insights of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Allyl-3-hydroxy-4-methoxybenzaldehyde. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Allyl-3-hydroxy-4-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Allyl-3-hydroxy-4-methoxybenzaldehyde has 1 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 2-Allyl-3-hydroxy-4-methoxybenzaldehyde?
The CAS number of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde is 18075-41-7.
What is the molecular formula of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde?
The molecular formula of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde is C11H12O3.
What is the molecular weight of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde?
The molecular weight of 2-Allyl-3-hydroxy-4-methoxybenzaldehyde is 192.08 g/mol.
Where can I buy 2-Allyl-3-hydroxy-4-methoxybenzaldehyde?
You can request a quote for 2-Allyl-3-hydroxy-4-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Allyl-3-hydroxy-4-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Allyl-3-hydroxy-4-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.