2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione
TL;DR: 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione (CAS 104261-15-6) is a chemical compound with molecular formula C16H20O2 and molecular weight 244.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,10-trimethyltricyclo[7.3.1.01,6]trideca-6,10-diene-2,8-dione
Also Known As: 4,4,10-trimethyltricyclo[7.3.1.0<1,6>]trideca-6,10-diene-2,8-dione, 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione, 2,2,7-trimethyl-5,8-dihydro-2H-4a,8-methanobenzo[8]annulene-4,9(1H,3H)-dione
| Molecular Formula | C16H20O2 |
|---|---|
| Molecular Weight | 244.15 g/mol |
| LogP | 3.2273 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.14633 |
| Heavy Atoms | 18 |
| Complexity | 507.19 |
Chemical Identifiers
| CAS Number | 104261-15-6 |
|---|---|
| SMILES | CC1=CCC23CC1C(=O)C=C2CC(CC3=O)(C)C |
Product Overview
2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione (CAS 104261-15-6), with molecular formula C16H20O2 and molecular weight 244.15 g/mol. IUPAC: 4,4,10-trimethyltricyclo[7.3.1.01,6]trideca-6,10-diene-2,8-dione.
Chemical Property Profile of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione
Property Insights of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione
The XLogP value of 3.2273 indicates that 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione has 0 hydrogen bond donor(s) and 2 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 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione?
The CAS number of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione is 104261-15-6.
What is the molecular formula of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione?
The molecular formula of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione is C16H20O2.
What is the molecular weight of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione?
The molecular weight of 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione is 244.15 g/mol.
Where can I buy 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione?
You can request a quote for 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,2,7-trimethyl-2,3-dihydro-1H-4a,8-methanobenzo[8]annulene-4,9(5H,8H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.