3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione
TL;DR: 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione (CAS 33343-40-7) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-5-methyl-2-[(2R)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione
Also Known As: Dihydroperezone, J3.050.266C, 3-hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione, 3-Hydroxy-5-methyl-2-((2R)-6-methylheptan-2-yl)cyclohexa-2,5-diene-1,4-dione, 2-Hydroxy-3-[(1R)-1,5-dimethylhexyl]-6-methyl-1,4-benzoquinone
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 33343-40-7 |
|---|---|
| SMILES | CC1=CC(=O)C(=C(C1=O)O)[C@H](C)CCCC(C)C |
| InChIKey | LVIYJPUFTCELQM-SNVBAGLBSA-N |
Product Overview
3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione (CAS 33343-40-7), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: 3-hydroxy-5-methyl-2-[(2R)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione
Property Insights of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione
The XLogP value of 3.8 indicates that 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione 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 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione?
The CAS number of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione is 33343-40-7.
What is the molecular formula of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione is C15H22O3.
What is the molecular weight of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione is 250.16 g/mol.
Where can I buy 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-5-methyl-2-[(2r)-6-methylheptan-2-yl]cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.