1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-
TL;DR: 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- (CAS 14727-47-0) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,7R,9R)-3,3,7,8-tetramethyltricyclo[5.4.0.02,9]undecan-10-one
Also Known As: Isolongifolanone, 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-, 2,2,7,7-Tetramethyltricyclo(6.2.1.0(sup 1,6))undecan-5-one, (1alpha,3Abeta,4alpha,8abeta,9S*)-octahydro-4,8,8,9-tetramethyl-1,4-methanoazulen-2(1H)-one, 1,3,4,6,7,8a-Hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalen-8(5H)-one
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 14727-47-0 |
|---|---|
| SMILES | CC1[C@@H]2[C@H]3[C@H]([C@@]1(CCCC3(C)C)C)CC2=O |
| InChIKey | XROGGPRBZBLTOH-WGVDIBCWSA-N |
Product Overview
1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- (CAS 14727-47-0), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: (1R,2R,7R,9R)-3,3,7,8-tetramethyltricyclo[5.4.0.02,9]undecan-10-one.
Chemical Property Profile of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-
Property Insights of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-
The XLogP value of 4.0 indicates that 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- 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 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-?
The CAS number of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- is 14727-47-0.
What is the molecular formula of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-?
The molecular formula of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- is C15H24O.
What is the molecular weight of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-?
The molecular weight of 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- is 220.18 g/mol.
Where can I buy 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-?
You can request a quote for 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Methanoazulen-2(1H)-one, octahydro-4,8,8,9-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.