2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-
TL;DR: 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- (CAS 4586-59-8) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-5-methyl-2-propan-2-ylcyclohexa-2,5-diene-1,4-dione
Also Known As: 5-Hydroxy-p-mentha-1,4-diene-3,6-dione, 3-Hydroxy-2-isopropyl-5-methylbenzo-1,4-quinone, J1.879.698H, 2-Hydroxy-3-isopropyl-6-methyl-1,4-benzoquinone, 2-Isopropyl-3-hydroxy-5-methyl-1,4-benzoquinone
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 4586-59-8 |
|---|---|
| SMILES | CC1=CC(=O)C(=C(C1=O)O)C(C)C |
| InChIKey | XCTGBWRNPBNMNX-UHFFFAOYSA-N |
Product Overview
2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- (CAS 4586-59-8), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 3-hydroxy-5-methyl-2-propan-2-ylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-
Property Insights of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-. With a topological polar surface area (TPSA) of 54.4 Ų, 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- 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 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-?
The CAS number of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- is 4586-59-8.
What is the molecular formula of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-?
The molecular formula of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- is C10H12O3.
What is the molecular weight of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-?
The molecular weight of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- is 180.08 g/mol.
Where can I buy 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-?
You can request a quote for 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-5-methyl-2-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.