4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol
TL;DR: 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol (CAS 56984-72-6) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxol-5-yl)but-3-en-2-ol
Also Known As: 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 56984-72-6 |
|---|---|
| SMILES | CC(C=CC1=CC2=C(C=C1)OCO2)O |
| InChIKey | BFKJEEFQRZRWBY-UHFFFAOYSA-N |
Product Overview
4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol (CAS 56984-72-6), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)but-3-en-2-ol.
Chemical Property Profile of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol
Property Insights of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol. With a topological polar surface area (TPSA) of 38.7 Ų, 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol has 1 hydrogen bond donor(s) and 3 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 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol?
The CAS number of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol is 56984-72-6.
What is the molecular formula of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol?
The molecular formula of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol is C11H12O3.
What is the molecular weight of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol?
The molecular weight of 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol is 192.08 g/mol.
Where can I buy 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol?
You can request a quote for 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-Methylenedioxyphenyl)-3-buten-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.