5-(Benzyloxy)-2-hydroxyisophthalaldehyde
TL;DR: 5-(Benzyloxy)-2-hydroxyisophthalaldehyde (CAS 181022-80-0) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-phenylmethoxybenzene-1,3-dicarbaldehyde
Also Known As: 5-(Benzyloxy)-2-hydroxyisophthalaldehyde, 5-(Benzyloxy)-2-hydroxyisophthalaldehyde #, 2-hydroxy-5-phenylmethoxybenzene-1,3-dicarbaldehyde, Benzene, 1-benzyloxy-3,5-diformyl-4-hydroxy-, AE-848/30539060
| Molecular Formula | C15H12O4 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.07355 |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 181022-80-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC(=C(C(=C2)C=O)O)C=O |
| InChIKey | NISXIAFDZWDHCL-UHFFFAOYSA-N |
Product Overview
5-(Benzyloxy)-2-hydroxyisophthalaldehyde (CAS 181022-80-0), with molecular formula C15H12O4 and molecular weight 256.07 g/mol. IUPAC: 2-hydroxy-5-phenylmethoxybenzene-1,3-dicarbaldehyde.
Chemical Property Profile of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde
Property Insights of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Benzyloxy)-2-hydroxyisophthalaldehyde. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Benzyloxy)-2-hydroxyisophthalaldehyde. Following Lipinski's Rule of Five, 5-(Benzyloxy)-2-hydroxyisophthalaldehyde has 1 hydrogen bond donor(s) and 4 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 5-(Benzyloxy)-2-hydroxyisophthalaldehyde?
The CAS number of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde is 181022-80-0.
What is the molecular formula of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde?
The molecular formula of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde is C15H12O4.
What is the molecular weight of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde?
The molecular weight of 5-(Benzyloxy)-2-hydroxyisophthalaldehyde is 256.07 g/mol.
Where can I buy 5-(Benzyloxy)-2-hydroxyisophthalaldehyde?
You can request a quote for 5-(Benzyloxy)-2-hydroxyisophthalaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Benzyloxy)-2-hydroxyisophthalaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-(Benzyloxy)-2-hydroxyisophthalaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.