2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde
TL;DR: 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde (CAS 364342-83-6) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde
Also Known As: 1-O-Demethyl-FR-202306, 1,5,6,7-Isobenzofurantetrol, 1,3-dihydro-4-methyl-, 2,3,4-trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde, 2,3,4-trihydroxy-6-(hydroxymethyl)-5-methyl-benzaldehyde
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.05 g/mol |
| LogP | 0.41662 |
| Topological Polar Surface Area | 97.99 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 383.52408 |
Chemical Identifiers
| CAS Number | 364342-83-6 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)O)O)C=O)CO |
Product Overview
2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde (CAS 364342-83-6), with molecular formula C9H10O5 and molecular weight 198.05 g/mol. IUPAC: 2,3,4-trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde.
Chemical Property Profile of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde
Property Insights of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde
The XLogP value of 0.41662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde. The TPSA of 97.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde. Following Lipinski's Rule of Five, 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde has 4 hydrogen bond donor(s) and 5 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 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde?
The CAS number of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde is 364342-83-6.
What is the molecular formula of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde?
The molecular formula of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde is C9H10O5.
What is the molecular weight of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde?
The molecular weight of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde is 198.05 g/mol.
Where can I buy 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde?
You can request a quote for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.