2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol
TL;DR: 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol (CAS 342652-60-2) is a chemical compound with molecular formula C9H12O5 and molecular weight 200.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-bis(hydroxymethyl)-6-methylbenzene-1,2,3-triol
Also Known As: 4,5-bis(hydroxymethyl)-6-methylbenzene-1,2,3-triol, J1.490.197C, 2,3,4-trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol, 4,5-bis(hydroxymethyl)-6-methyl-benzene-1,2,3-triol, 2,3,4-trihydroxy-6-(hydroxymethyl)-5-methylbenzylalcohol
| Molecular Formula | C9H12O5 |
|---|---|
| Molecular Weight | 200.07 g/mol |
| LogP | 0.09642 |
| Topological Polar Surface Area | 101.15 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.06847 |
| Heavy Atoms | 14 |
| Complexity | 323.95532 |
Chemical Identifiers
| CAS Number | 342652-60-2 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)O)O)CO)CO |
Product Overview
2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol (CAS 342652-60-2), with molecular formula C9H12O5 and molecular weight 200.07 g/mol. IUPAC: 4,5-bis(hydroxymethyl)-6-methylbenzene-1,2,3-triol.
Chemical Property Profile of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol
Property Insights of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol
The XLogP value of 0.09642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol. The TPSA of 101.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol. Following Lipinski's Rule of Five, 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol has 5 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-methylbenzylacohol?
The CAS number of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol is 342652-60-2.
What is the molecular formula of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol?
The molecular formula of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol is C9H12O5.
What is the molecular weight of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol?
The molecular weight of 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol is 200.07 g/mol.
Where can I buy 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol?
You can request a quote for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol 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-methylbenzylacohol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trihydroxy-6-(hydroxymethyl)-5-methylbenzylacohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.