![3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one structure](/static/products/943/943517-63-3.png)
3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one
TL;DR: 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one (CAS 943517-63-3) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one
Also Known As: Alpha-isomethylionone, 3-Methyl-4-[(1R)-2,6,6-trimethyl-2-cyclohexen-1-yl]-3-buten-2-one, 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.9042 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 318.2304 |
Chemical Identifiers
| CAS Number | 943517-63-3 |
|---|---|
| SMILES | CC1=CCCC([C@H]1C=C(C)C(=O)C)(C)C |
Product Overview
3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one (CAS 943517-63-3), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one.
Chemical Property Profile of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one
Property Insights of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one
The XLogP value of 3.9042 indicates that 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one has 0 hydrogen bond donor(s) and 1 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-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one?
The CAS number of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one is 943517-63-3.
What is the molecular formula of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one?
The molecular formula of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one is C14H22O.
What is the molecular weight of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one?
The molecular weight of 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one is 206.17 g/mol.
Where can I buy 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one?
You can request a quote for 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]but-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.