4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one
TL;DR: 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one (CAS 7224-62-6) is a chemical compound with molecular formula C14H20O3 and molecular weight 236.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8a-dihydroxy-4-methyl-7-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-azulen-2-one
Also Known As: 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one, 4,8a-dihydroxy-4-methyl-7-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-azulen-2-one
| Molecular Formula | C14H20O3 |
|---|---|
| Molecular Weight | 236.14 g/mol |
| LogP | 1.7439 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.14125 |
| Heavy Atoms | 17 |
| Complexity | 405.6904 |
Chemical Identifiers
| CAS Number | 7224-62-6 |
|---|---|
| SMILES | CC(=C)C1CCC(C2=CC(=O)CC2(C1)O)(C)O |
Product Overview
4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one (CAS 7224-62-6), with molecular formula C14H20O3 and molecular weight 236.14 g/mol. IUPAC: 4,8a-dihydroxy-4-methyl-7-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-azulen-2-one.
Chemical Property Profile of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one
Property Insights of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one
The XLogP value of 1.7439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one. With a topological polar surface area (TPSA) of 57.53 Ų, 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one has 2 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 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one?
The CAS number of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one is 7224-62-6.
What is the molecular formula of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one?
The molecular formula of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one is C14H20O3.
What is the molecular weight of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one?
The molecular weight of 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one is 236.14 g/mol.
Where can I buy 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one?
You can request a quote for 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4,8a-Dihydroxy-4-methyl-7-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydroazulen-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.