![1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone structure](/static/products/7339/73398-84-2.webp)
1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone
TL;DR: 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone (CAS 73398-84-2) is a chemical compound with molecular formula C17H28O and molecular weight 248.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone
Also Known As: Methyl cedryl ketone, CROTONICACIDSEC-BUTYLESTER, I14-6967, Ethanone, 1-((3R,3aS,6S,7R,8aS)-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl)-, Ethanone, 1-(octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl)-, [3R-(3.alpha.,3a.beta.,6.beta.,7.beta.,8a.alpha.)]-
| Molecular Formula | C17H28O |
|---|---|
| Molecular Weight | 248.21 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.21402 |
| Heavy Atoms | 18 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 73398-84-2 |
|---|---|
| SMILES | C[C@@H]1CC[C@@H]2C13CC[C@]([C@H](C3)C2(C)C)(C)C(=O)C |
| InChIKey | ZSPIIBJQRZLFHP-WRHXGLHUSA-N |
Product Overview
1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone (CAS 73398-84-2), with molecular formula C17H28O and molecular weight 248.21 g/mol. IUPAC: 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone.
Chemical Property Profile of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone
Property Insights of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone
The XLogP value of 4.7 indicates that 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone 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 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone?
The CAS number of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone is 73398-84-2.
What is the molecular formula of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone?
The molecular formula of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone is C17H28O.
What is the molecular weight of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone?
The molecular weight of 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone is 248.21 g/mol.
Where can I buy 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone?
You can request a quote for 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2R,5S,7R,8S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.