5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran
TL;DR: 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran (CAS 4918-77-8) is a chemical compound with molecular formula C29H36O2 and molecular weight 416.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,15,15,19-tetramethyl-5,20-dioxapentacyclo[17.8.0.04,13.06,11.021,26]heptacosa-6,8,10,16,21,23,25-heptaene
Also Known As: 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran
| Molecular Formula | C29H36O2 |
|---|---|
| Molecular Weight | 416.27 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 416.27155 |
| Heavy Atoms | 31 |
| Complexity | 668.0 |
Chemical Identifiers
| CAS Number | 4918-77-8 |
|---|---|
| SMILES | CC1(CC2CC3=CC=CC=C3OC2(CCC4CC5=CC=CC=C5OC4(CC=C1)C)C)C |
| InChIKey | ISSPUSZYYOWQJE-UHFFFAOYSA-N |
Product Overview
5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran (CAS 4918-77-8), with molecular formula C29H36O2 and molecular weight 416.27 g/mol. IUPAC: 4,15,15,19-tetramethyl-5,20-dioxapentacyclo[17.8.0.04,13.06,11.021,26]heptacosa-6,8,10,16,21,23,25-heptaene.
Chemical Property Profile of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran
Property Insights of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran
The XLogP value of 7.7 indicates that 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran 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 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran?
The CAS number of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran is 4918-77-8.
What is the molecular formula of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran?
The molecular formula of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran is C29H36O2.
What is the molecular weight of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran?
The molecular weight of 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran is 416.27 g/mol.
Where can I buy 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran?
You can request a quote for 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran?
Yes, KEHONG BIO provides custom synthesis services for 5a,9,9,16a-Tetramethyl-5a,6,9,10,10a,16a,17,18,18a,19-decahydro-11H-dibenzo[e,e']cycloundeca[1,11-b:5,4-b']dipyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.