5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-
TL;DR: 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- (CAS 58344-91-5) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-6-(1,3-benzodioxol-5-yl)-2-methylhex-5-ene-2,4-diol
Also Known As: D 732, 6-(1,3-Benzodioxol-5-yl)-2-methyl-5-hexene-2,4-diol, 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-, (E)-6-(1,3-benzodioxol-5-yl)-2-methylhex-5-ene-2,4-diol
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 1.9504 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 445.59747 |
Chemical Identifiers
| CAS Number | 58344-91-5 |
|---|---|
| SMILES | CC(C)(CC(/C=C/C1=CC2=C(C=C1)OCO2)O)O |
Product Overview
5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- (CAS 58344-91-5), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: (E)-6-(1,3-benzodioxol-5-yl)-2-methylhex-5-ene-2,4-diol.
Chemical Property Profile of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-
Property Insights of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-
The XLogP value of 1.9504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-. With a topological polar surface area (TPSA) of 58.92 Ų, 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- has 2 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-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-?
The CAS number of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- is 58344-91-5.
What is the molecular formula of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-?
The molecular formula of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- is C14H18O4.
What is the molecular weight of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-?
The molecular weight of 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- is 250.12 g/mol.
Where can I buy 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-?
You can request a quote for 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 5-Hexene-2,4-diol, 6-(1,3-benzodioxol-5-yl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.