![[5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol structure](/static/products/7942/79422-40-5.webp)
[5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol
TL;DR: [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol (CAS 79422-40-5) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-1,3-benzodioxol-5-yl]methanol
Also Known As: [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol|(2H,2'H-[5,5'-Bi-1,3-benzodioxole]-6,6'-diyl)dimethanol|[6-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-1,3-benzodioxol-5-yl]methanol
| Molecular Formula | C16H14O6 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.07904 |
| Heavy Atoms | 22 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 79422-40-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)CO)C3=CC4=C(C=C3CO)OCO4 |
| InChIKey | KNNPVLGXUKWPMQ-UHFFFAOYSA-N |
Product Overview
[5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol (CAS 79422-40-5), with molecular formula C16H14O6 and molecular weight 302.08 g/mol. IUPAC: [6-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-1,3-benzodioxol-5-yl]methanol.
Chemical Property Profile of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol
Property Insights of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol. Following Lipinski's Rule of Five, [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol has 2 hydrogen bond donor(s) and 6 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 [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol?
The CAS number of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol is 79422-40-5.
What is the molecular formula of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol?
The molecular formula of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol is C16H14O6.
What is the molecular weight of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol?
The molecular weight of [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol is 302.08 g/mol.
Where can I buy [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol?
You can request a quote for [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol?
Yes, KEHONG BIO provides custom synthesis services for [5,5'-Bi-1,3-benzodioxole]-6,6'-dimethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.