![4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one structure](/static/products/2061/2061-75-8.webp)
4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one
TL;DR: 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one (CAS 2061-75-8) is a chemical compound with molecular formula C26H42O2 and molecular weight 386.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9a,11a-dimethyl-1-(6-methylheptan-2-yl)-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-indeno[5,4-f]chromen-7-one
Also Known As: 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one, 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-indeno[5,4-f]chromen-7-one
| Molecular Formula | C26H42O2 |
|---|---|
| Molecular Weight | 386.32 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.31848 |
| Heavy Atoms | 28 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 2061-75-8 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(=O)O4)C)C |
| InChIKey | OCRQTYXHLVPEOL-UHFFFAOYSA-N |
Product Overview
4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one (CAS 2061-75-8), with molecular formula C26H42O2 and molecular weight 386.32 g/mol. IUPAC: 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-2,3,3a,3b,4,8,9,9b,10,11-decahydro-1H-indeno[5,4-f]chromen-7-one.
Chemical Property Profile of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one
Property Insights of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one
The XLogP value of 8.4 indicates that 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one?
The CAS number of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one is 2061-75-8.
What is the molecular formula of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one?
The molecular formula of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one is C26H42O2.
What is the molecular weight of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one?
The molecular weight of 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one is 386.32 g/mol.
Where can I buy 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one?
You can request a quote for 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4a,6a-Dimethyl-7-(6-methylheptan-2-yl)-4,4a,4b,5,6,6a,7,8,9,9a,9b,10-dodecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.